Ligand source activities (1 row/activity)
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | ||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
AssayType |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| 59304608 | 75259 | 0 | None | 3 | 4 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036954 | 75259 | 0 | None | 3 | 4 | Human | 9.0 | pEC50 | = | 9 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 46890269 | 7374 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 381 | 7 | 3 | 3 | 4.5 | CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086353 | 7374 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 381 | 7 | 3 | 3 | 4.5 | CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 15605648 | 75257 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 290 | 3 | 2 | 4 | 1.1 | O=c1[nH]c(=O)c2c(CCCC(F)(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036952 | 75257 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 290 | 3 | 2 | 4 | 1.1 | O=c1[nH]c(=O)c2c(CCCC(F)(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 15604638 | 75262 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 276 | 5 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036957 | 75262 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8 | Functional | ChEMBL | 276 | 5 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 145957566 | 162287 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4164140 | 162287 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 145957566 | 162287 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4164140 | 162287 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 156010038 | 177030 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4632359 | 177030 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 776464 | 93709 | 97 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 152 | 2 | 2 | 2 | 1.0 | O=C(O)c1cc(C2CC2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL247098 | 93709 | 97 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 152 | 2 | 2 | 2 | 1.0 | O=C(O)c1cc(C2CC2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2011.12.041 | ||
| 17751630 | 6745 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 487 | 7 | 3 | 7 | 2.8 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083743 | 6745 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 487 | 7 | 3 | 7 | 2.8 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 156016715 | 177675 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4641756 | 177675 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1 | 10.1016/j.bmcl.2020.127105 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 11594881 | 88638 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL235740 | 88638 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 11523095 | 184187 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 347 | 7 | 2 | 2 | 4.9 | O=C(CCCCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL483153 | 184187 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 347 | 7 | 2 | 2 | 4.9 | O=C(CCCCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 11594881 | 88638 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL235740 | 88638 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | ||
| 776464 | 93709 | 97 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 152 | 2 | 2 | 2 | 1.0 | O=C(O)c1cc(C2CC2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247098 | 93709 | 97 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 152 | 2 | 2 | 2 | 1.0 | O=C(O)c1cc(C2CC2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | ||
| 54585613 | 61399 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 392 | 5 | 4 | 6 | 1.9 | NC(Cc1cc2n(n1)-c1ccc(O)cc1CC2)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770174 | 61399 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 392 | 5 | 4 | 6 | 1.9 | NC(Cc1cc2n(n1)-c1ccc(O)cc1CC2)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 57402396 | 69917 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 236 | 3 | 1 | 5 | 0.8 | CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939012 | 69917 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 236 | 3 | 1 | 5 | 0.8 | CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 57397200 | 69920 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 312 | 5 | 1 | 5 | 2.1 | CCc1cc(=O)oc2nc(OCCc3ccccc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939015 | 69920 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 312 | 5 | 1 | 5 | 2.1 | CCc1cc(=O)oc2nc(OCCc3ccccc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 57400597 | 69939 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 303 | 4 | 1 | 7 | 1.3 | CCc1cc(=O)oc2nc(OCc3cc(C)on3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939034 | 69939 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5 | Functional | ChEMBL | 303 | 4 | 1 | 7 | 1.3 | CCc1cc(=O)oc2nc(OCc3cc(C)on3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 145954324 | 162512 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 402 | 2 | 1 | 5 | 5.0 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3cccs3)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4167588 | 162512 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 402 | 2 | 1 | 5 | 5.0 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3cccs3)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 90645405 | 112533 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL3299113 | 112533 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6 | Functional | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 145954324 | 162512 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 402 | 2 | 1 | 5 | 5.0 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3cccs3)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4167588 | 162512 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 402 | 2 | 1 | 5 | 5.0 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3cccs3)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 11672831 | 76040 | 4 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 192 | 1 | 2 | 2 | 1.4 | CC1(C)C2Cc3c(C(=O)O)n[nH]c3C21 | 10.1021/jm2010964 | ||
| CHEMBL2057235 | 76040 | 4 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 192 | 1 | 2 | 2 | 1.4 | CC1(C)C2Cc3c(C(=O)O)n[nH]c3C21 | 10.1021/jm2010964 | ||
| 776416 | 18938 | 108 | None | -5 | 2 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL128604 | 18938 | 108 | None | -5 | 2 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 11550911 | 95188 | 1 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 280 | 3 | 2 | 2 | 2.5 | O=C(O)c1cc(Cc2cccc(Br)c2)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL255877 | 95188 | 1 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 280 | 3 | 2 | 2 | 2.5 | O=C(O)c1cc(Cc2cccc(Br)c2)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 57397201 | 69928 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccc(OC)cc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939023 | 69928 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccc(OC)cc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 53325342 | 58038 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 336 | 6 | 1 | 4 | 3.3 | O=c1cc(CCCC2(C3CC3)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672642 | 58038 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 336 | 6 | 1 | 4 | 3.3 | O=c1cc(CCCC2(C3CC3)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 24954941 | 58041 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 296 | 4 | 1 | 4 | 2.5 | O=c1cc(CCC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672732 | 58041 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 296 | 4 | 1 | 4 | 2.5 | O=c1cc(CCC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 11159621 | 2548 | 46 | None | 1 | 3 | Mouse | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 5784 | 2548 | 46 | None | 1 | 3 | Mouse | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL456145 | 2548 | 46 | None | 1 | 3 | Mouse | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| DB05939 | 2548 | 46 | None | 1 | 3 | Mouse | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 776421 | 89928 | 108 | None | 30 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL238002 | 89928 | 108 | None | 30 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 13153555 | 93863 | 27 | None | 42 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL247921 | 93863 | 27 | None | 42 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| 46890327 | 6600 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 451 | 6 | 3 | 3 | 5.2 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083138 | 6600 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 451 | 6 | 3 | 3 | 5.2 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 59304946 | 75247 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 268 | 4 | 2 | 5 | 0.5 | CSCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036828 | 75247 | 0 | None | - | 1 | Human | 8.0 | pEC50 | = | 8.0 | Functional | ChEMBL | 268 | 4 | 2 | 5 | 0.5 | CSCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 11483496 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm800896z | ||
| 1589 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm800896z | ||
| CHEMBL375493 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm800896z | ||
| 11483496 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 1589 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| CHEMBL375493 | 126 | 0 | None | 14 | 2 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 135416383 | 184909 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 368 | 5 | 3 | 5 | 2.7 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | ||
| CHEMBL485326 | 184909 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 368 | 5 | 3 | 5 | 2.7 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | ||
| 59304655 | 75246 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 252 | 4 | 2 | 5 | -0.3 | COCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036827 | 75246 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 252 | 4 | 2 | 5 | -0.3 | COCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 137652577 | 158760 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 329 | 3 | 3 | 3 | 2.5 | O=C(/C=C/C#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4093990 | 158760 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 329 | 3 | 3 | 3 | 2.5 | O=C(/C=C/C#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11184165 | 83454 | 0 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 246 | 3 | 1 | 3 | 2.0 | CCc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| CHEMBL219950 | 83454 | 0 | None | 5 | 2 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 246 | 3 | 1 | 3 | 2.0 | CCc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| 12003788 | 194941 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1237148 | 194941 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL542000 | 194941 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 12003787 | 195842 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 296 | 2 | 2 | 2 | 2.8 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL558463 | 195842 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 296 | 2 | 2 | 2 | 2.8 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 16048917 | 154014 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2ncc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)nc12 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL398414 | 154014 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2ncc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)nc12 | 10.1016/j.bmcl.2007.10.055 | ||
| 135401974 | 154723 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3cccc(O)c3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL399859 | 154723 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3cccc(O)c3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 46889338 | 6724 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 214 | 2 | 2 | 4 | 0.7 | C=C[C@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083683 | 6724 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 214 | 2 | 2 | 4 | 0.7 | C=C[C@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 53317449 | 58061 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 222 | 2 | 2 | 5 | -0.1 | CCc1cc(=O)oc2nc(CO)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672767 | 58061 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 222 | 2 | 2 | 5 | -0.1 | CCc1cc(=O)oc2nc(CO)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 57413448 | 76351 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 234 | 5 | 2 | 2 | 2.6 | CCCCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059226 | 76351 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 234 | 5 | 2 | 2 | 2.6 | CCCCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 57395376 | 69926 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccccc3OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939021 | 69926 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccccc3OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 57412210 | 76115 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2c3[nH]nc(C(=O)O)c3C[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057616 | 76115 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2c3[nH]nc(C(=O)O)c3C[C@H]12 | 10.1021/jm2010964 | ||
| 15605571 | 75235 | 2 | None | -1 | 5 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036813 | 75235 | 2 | None | -1 | 5 | Mouse | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 49763030 | 76117 | 31 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 164 | 1 | 2 | 2 | 0.8 | O=C(O)c1n[nH]c2c1C[C@H]1C[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057618 | 76117 | 31 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 164 | 1 | 2 | 2 | 0.8 | O=C(O)c1n[nH]c2c1C[C@H]1C[C@@H]21 | 10.1021/jm2010964 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm070022x | ||
| 135800177 | 145951 | 7 | None | 24 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL391813 | 145951 | 7 | None | 24 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 11617852 | 184535 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 381 | 5 | 3 | 6 | 3.5 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL484783 | 184535 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 381 | 5 | 3 | 6 | 3.5 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 25101223 | 1152 | 7 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 5795 | 1152 | 7 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490599 | 1152 | 7 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 135800177 | 145951 | 7 | None | 24 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL391813 | 145951 | 7 | None | 24 | 2 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 11992586 | 195500 | 9 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 217 | 4 | 3 | 3 | 1.7 | O=C(O)c1cc(NCc2ccccc2)[nH]n1 | 10.1016/j.bmcl.2009.05.108 | ||
| CHEMBL553435 | 195500 | 9 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 217 | 4 | 3 | 3 | 1.7 | O=C(O)c1cc(NCc2ccccc2)[nH]n1 | 10.1016/j.bmcl.2009.05.108 | ||
| 11160694 | 138156 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2cccc(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL376889 | 138156 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2cccc(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 4268702 | 169652 | 8 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 327 | 5 | 2 | 3 | 3.7 | CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL443733 | 169652 | 8 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 327 | 5 | 2 | 3 | 3.7 | CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 145984458 | 165495 | 0 | None | -1 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 600 | 7 | 2 | 8 | 4.6 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)C[Si](C)(c2ccc(OC)cc2)CC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| CHEMBL4240407 | 165495 | 0 | None | -1 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 600 | 7 | 2 | 8 | 4.6 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)C[Si](C)(c2ccc(OC)cc2)CC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| 11322761 | 141606 | 1 | None | 1 | 2 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2ccc(F)cc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL385103 | 141606 | 1 | None | 1 | 2 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2ccc(F)cc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 44441318 | 93791 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 228 | 2 | 2 | 2 | 2.2 | O=C(O)c1[nH]nc2c1CCC2c1ccccc1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247527 | 93791 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 228 | 2 | 2 | 2 | 2.2 | O=C(O)c1[nH]nc2c1CCC2c1ccccc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 11845295 | 149578 | 42 | None | -1 | 2 | Mouse | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1021/jm800258p | ||
| CHEMBL394688 | 149578 | 42 | None | -1 | 2 | Mouse | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1021/jm800258p | ||
| 44441310 | 149283 | 4 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 170 | 4 | 2 | 3 | 0.3 | COCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394464 | 149283 | 4 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 170 | 4 | 2 | 3 | 0.3 | COCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 57393654 | 69916 | 2 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 222 | 2 | 1 | 5 | 0.4 | CCc1cc(=O)oc2nc(OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939011 | 69916 | 2 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 222 | 2 | 1 | 5 | 0.4 | CCc1cc(=O)oc2nc(OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 882926 | 85607 | 13 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm200371q | ||
| CHEMBL228244 | 85607 | 13 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm200371q | ||
| 882926 | 85607 | 13 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL228244 | 85607 | 13 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 90645413 | 112483 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 4.0 | O=C(O)C1=C(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3298703 | 112483 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 335 | 4 | 2 | 2 | 4.0 | O=C(O)C1=C(NC(=O)[C@@H]2C[C@H]2c2ccc3ccccc3c2)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 53326893 | 58048 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 260 | 1 | 1 | 4 | 1.5 | CCc1cc(=O)oc2nc(C(F)(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672742 | 58048 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 260 | 1 | 1 | 4 | 1.5 | CCc1cc(=O)oc2nc(C(F)(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 24954204 | 58056 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 284 | 5 | 1 | 4 | 2.5 | CCCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672751 | 58056 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 284 | 5 | 1 | 4 | 2.5 | CCCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 57413453 | 76473 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 190 | 2 | 2 | 2 | 1.2 | C=C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059825 | 76473 | 1 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 190 | 2 | 2 | 2 | 1.2 | C=C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 46889360 | 7107 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 228 | 3 | 2 | 4 | 1.1 | C=CC[C@@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085200 | 7107 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 228 | 3 | 2 | 4 | 1.1 | C=CC[C@@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 15605654 | 75258 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 248 | 3 | 2 | 4 | 0.5 | O=c1[nH]c(=O)c2c(CCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036953 | 75258 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 248 | 3 | 2 | 4 | 0.5 | O=c1[nH]c(=O)c2c(CCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 46890299 | 7215 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085655 | 7215 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 53322717 | 58046 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 322 | 4 | 1 | 4 | 2.9 | O=c1cc(CCC2CC3(CC3)C2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672738 | 58046 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 322 | 4 | 1 | 4 | 2.9 | O=c1cc(CCC2CC3(CC3)C2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 137633734 | 156321 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4065654 | 156321 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 137641317 | 157011 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 383 | 6 | 2 | 2 | 5.0 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4073374 | 157011 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 383 | 6 | 2 | 2 | 5.0 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmcl.2009.05.108 | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 24741310 | 89622 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL237543 | 89622 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 44580038 | 186949 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 444 | 8 | 1 | 6 | 4.6 | COc1ccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)cc1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490221 | 186949 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 444 | 8 | 1 | 6 | 4.6 | COc1ccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)cc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 44579693 | 187091 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | Cc1cccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)c1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL491396 | 187091 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | Cc1cccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)c1 | 10.1016/j.bmcl.2008.08.039 | ||
| 13557 | 1106 | 111 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 853085 | 1106 | 111 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL393428 | 1106 | 111 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 12003788 | 194941 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1237148 | 194941 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL542000 | 194941 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 12002717 | 196742 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 302 | 2 | 2 | 4 | 2.1 | Fc1ccc(F)c(C2CCc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL565163 | 196742 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 302 | 2 | 2 | 4 | 2.1 | Fc1ccc(F)c(C2CCc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.06.054 | ||
| 15605357 | 75240 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 224 | 1 | 3 | 5 | -0.8 | CC(O)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036821 | 75240 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 224 | 1 | 3 | 5 | -0.8 | CC(O)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 145984088 | 165815 | 0 | None | -1 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 630 | 8 | 2 | 9 | 4.6 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)C[Si](C)(c2c(OC)cccc2OC)CC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| CHEMBL4248415 | 165815 | 0 | None | -1 | 2 | Rat | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 630 | 8 | 2 | 9 | 4.6 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)C[Si](C)(c2c(OC)cccc2OC)CC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| 16048995 | 94655 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 375 | 3 | 2 | 3 | 3.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252505 | 94655 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 375 | 3 | 2 | 3 | 3.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 16048992 | 94682 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 403 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252707 | 94682 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 403 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 15605498 | 69929 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3ccccc3C(F)(F)F)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939024 | 69929 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3ccccc3C(F)(F)F)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 88707 | 93757 | 141 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 201 | 1 | 1 | 2 | 1.5 | O=C(O)c1cncc(Br)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247336 | 93757 | 141 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 201 | 1 | 1 | 2 | 1.5 | O=C(O)c1cncc(Br)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| 24954940 | 69949 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 336 | 4 | 1 | 5 | 2.3 | CCC#CCOc1nc2oc(=O)cc(Cc3ccccc3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939044 | 69949 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 336 | 4 | 1 | 5 | 2.3 | CCC#CCOc1nc2oc(=O)cc(Cc3ccccc3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 46890401 | 7287 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 460 | 7 | 3 | 4 | 4.9 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086031 | 7287 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 460 | 7 | 3 | 4 | 4.9 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 57393655 | 69921 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 266 | 5 | 1 | 6 | 0.5 | CCc1cc(=O)oc2nc(OCCOC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939016 | 69921 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 266 | 5 | 1 | 6 | 0.5 | CCc1cc(=O)oc2nc(OCCOC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 57392461 | 69871 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 240 | 1 | 1 | 5 | -0.1 | Cc1cc(=O)oc2nc([S+](C)[O-])[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1938888 | 69871 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 240 | 1 | 1 | 5 | -0.1 | Cc1cc(=O)oc2nc([S+](C)[O-])[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 11514051 | 76112 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 218 | 1 | 2 | 2 | 1.9 | O=C(O)c1n[nH]c2c1CC1C2C12CCCC2 | 10.1021/jm2010964 | ||
| CHEMBL2057610 | 76112 | 0 | None | - | 1 | Human | 7.9 | pEC50 | = | 7.9 | Functional | ChEMBL | 218 | 1 | 2 | 2 | 1.9 | O=C(O)c1n[nH]c2c1CC1C2C12CCCC2 | 10.1021/jm2010964 | ||
| 135899178 | 16210 | 0 | None | -2 | 2 | Rat | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224219 | 16210 | 0 | None | -2 | 2 | Rat | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 156016157 | 177778 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 430 | 8 | 3 | 4 | 3.2 | CCCCN1CC(C(=O)O)=C(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)C1=O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4643073 | 177778 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 430 | 8 | 3 | 4 | 3.2 | CCCCN1CC(C(=O)O)=C(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)C1=O | 10.1016/j.bmcl.2020.127105 | ||
| 44579780 | 187160 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 442 | 8 | 1 | 5 | 4.8 | COCC(Cc1ccccc1)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL492027 | 187160 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 442 | 8 | 1 | 5 | 4.8 | COCC(Cc1ccccc1)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | ||
| 90645401 | 112481 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 337 | 4 | 3 | 3 | 3.6 | O=C(/C=C/c1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3298701 | 112481 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 337 | 4 | 3 | 3 | 3.6 | O=C(/C=C/c1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 1591 | 131 | 63 | None | 33 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 6485181 | 131 | 63 | None | 33 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL428730 | 131 | 63 | None | 33 | 2 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 156020831 | 178070 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 386 | 8 | 4 | 8 | 1.5 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4647398 | 178070 | 0 | None | - | 1 | Human | 4.9 | pEC50 | = | 4.9 | Functional | ChEMBL | 386 | 8 | 4 | 8 | 1.5 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 24954566 | 58032 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 310 | 4 | 1 | 4 | 2.9 | O=c1cc(CCC2CCCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672637 | 58032 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 310 | 4 | 1 | 4 | 2.9 | O=c1cc(CCC2CCCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 57413544 | 76107 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 208 | 3 | 2 | 3 | 0.6 | COC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057603 | 76107 | 0 | None | - | 1 | Human | 6.9 | pEC50 | = | 6.9 | Functional | ChEMBL | 208 | 3 | 2 | 3 | 0.6 | COC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| 46889361 | 6831 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 228 | 3 | 2 | 4 | 1.1 | C=CC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083988 | 6831 | 0 | None | - | 1 | Human | 5.9 | pEC50 | = | 5.9 | Functional | ChEMBL | 228 | 3 | 2 | 4 | 1.1 | C=CC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 11660694 | 178068 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4647392 | 178068 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 24955646 | 58034 | 0 | None | -2 | 4 | Mouse | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| CHEMBL1672639 | 58034 | 0 | None | -2 | 4 | Mouse | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| 156019027 | 177797 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(C(=O)O)c(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)n1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4643451 | 177797 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(C(=O)O)c(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)n1 | 10.1016/j.bmcl.2020.127105 | ||
| 156020512 | 178104 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 403 | 9 | 3 | 8 | 2.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCF)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4647933 | 178104 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 403 | 9 | 3 | 8 | 2.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCF)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 12430656 | 147734 | 88 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 129 | 1 | 1 | 3 | 0.8 | O=C(O)c1cnsc1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL393226 | 147734 | 88 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 129 | 1 | 1 | 3 | 0.8 | O=C(O)c1cnsc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 136000669 | 61404 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 382 | 7 | 4 | 7 | 1.9 | CN[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770179 | 61404 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 382 | 7 | 4 | 7 | 1.9 | CN[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 44433527 | 88534 | 11 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 150 | 1 | 2 | 4 | -0.1 | Cc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235228 | 88534 | 11 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 150 | 1 | 2 | 4 | -0.1 | Cc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 44433531 | 88537 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 168 | 1 | 2 | 4 | 0.0 | Cc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235231 | 88537 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 168 | 1 | 2 | 4 | 0.0 | Cc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 46889339 | 7180 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 214 | 2 | 2 | 4 | 0.7 | C=C[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085534 | 7180 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 214 | 2 | 2 | 4 | 0.7 | C=C[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 135416394 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 5788 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 73755154 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| CHEMBL1086657 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 70683908 | 75040 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 280 | 4 | 2 | 4 | 1.0 | O=c1[nH]c(=O)c2c(CCCC3(F)CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2035002 | 75040 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 280 | 4 | 2 | 4 | 1.0 | O=c1[nH]c(=O)c2c(CCCC3(F)CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 59343651 | 75263 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 290 | 5 | 2 | 4 | 1.7 | CCC1(CCCc2cc(=O)oc3[nH]c(=O)[nH]c(=O)c23)CC1 | 10.1021/ml200243g | ||
| CHEMBL2036959 | 75263 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 290 | 5 | 2 | 4 | 1.7 | CCC1(CCCc2cc(=O)oc3[nH]c(=O)[nH]c(=O)c23)CC1 | 10.1021/ml200243g | ||
| 57413367 | 76113 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057614 | 76113 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 137635325 | 156149 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4063682 | 156149 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11322738 | 136766 | 1 | None | 13 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 252 | 2 | 1 | 3 | 2.1 | CC1(c2cccc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL374111 | 136766 | 1 | None | 13 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 252 | 2 | 1 | 3 | 2.1 | CC1(c2cccc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 136375410 | 177317 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 370 | 7 | 3 | 7 | 2.5 | CCn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4636989 | 177317 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 370 | 7 | 3 | 7 | 2.5 | CCn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 16048770 | 94631 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252306 | 94631 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 59304808 | 75237 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 262 | 1 | 2 | 4 | 0.3 | O=c1[nH]c(=O)c2c(CC(F)(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036816 | 75237 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 262 | 1 | 2 | 4 | 0.3 | O=c1[nH]c(=O)c2c(CC(F)(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 135800177 | 145951 | 7 | None | -24 | 2 | Mouse | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL391813 | 145951 | 7 | None | -24 | 2 | Mouse | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 135899325 | 16193 | 0 | None | -1 | 2 | Rat | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224147 | 16193 | 0 | None | -1 | 2 | Rat | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 1592 | 144 | 131 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 256208 | 144 | 131 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247132 | 144 | 131 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 44441302 | 93355 | 23 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 166 | 2 | 2 | 2 | 1.4 | O=C(O)c1cc(C2CCC2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL245491 | 93355 | 23 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 166 | 2 | 2 | 2 | 1.4 | O=C(O)c1cc(C2CCC2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 57412217 | 76348 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 206 | 3 | 2 | 2 | 1.8 | CCC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2059223 | 76348 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 206 | 3 | 2 | 2 | 1.8 | CCC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 11159621 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 5784 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL456145 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| DB05939 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 145957566 | 162287 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4164140 | 162287 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 145957566 | 162287 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4164140 | 162287 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 426 | 3 | 1 | 5 | 5.0 | COc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 21660892 | 147518 | 0 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 136 | 1 | 2 | 4 | -0.4 | c1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL393063 | 147518 | 0 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 136 | 1 | 2 | 4 | -0.4 | c1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 136086823 | 6969 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 400 | 8 | 3 | 7 | 2.8 | CCCC1CCC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084576 | 6969 | 0 | None | - | 1 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 400 | 8 | 3 | 7 | 2.8 | CCCC1CCC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 15605571 | 75235 | 2 | None | -3 | 5 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036813 | 75235 | 2 | None | -3 | 5 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.8 | pEC50 | = | 7.8 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | ||
| 135399731 | 184157 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc2c(c1CCC(=O)Nc1ccccc1C(=O)O)CCc1cc(O)ccc1-2 | 10.1021/jm900151e | ||
| CHEMBL482963 | 184157 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc2c(c1CCC(=O)Nc1ccccc1C(=O)O)CCc1cc(O)ccc1-2 | 10.1021/jm900151e | ||
| 70681781 | 75239 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 288 | 2 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(Cc3ccc(F)cc3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036820 | 75239 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 288 | 2 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(Cc3ccc(F)cc3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 136127010 | 16086 | 11 | None | -9 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1223819 | 16086 | 11 | None | -9 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 16048843 | 154391 | 0 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 392 | 3 | 3 | 6 | 2.3 | Nc1ccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc2c1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL398762 | 154391 | 0 | None | - | 1 | Human | 4.8 | pEC50 | = | 4.8 | Functional | ChEMBL | 392 | 3 | 3 | 6 | 2.3 | Nc1ccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc2c1 | 10.1016/j.bmcl.2007.10.055 | ||
| 24953857 | 69951 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 342 | 5 | 1 | 5 | 2.8 | CCC#CCOc1nc2oc(=O)cc(CCC3CCCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939046 | 69951 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 342 | 5 | 1 | 5 | 2.8 | CCC#CCOc1nc2oc(=O)cc(CCC3CCCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 57400598 | 69945 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 328 | 3 | 1 | 5 | 2.4 | CCc1cc(=O)oc2nc(OCC#CC3CCCCC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939040 | 69945 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 328 | 3 | 1 | 5 | 2.4 | CCc1cc(=O)oc2nc(OCC#CC3CCCCC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 57413446 | 76347 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 206 | 3 | 2 | 2 | 1.8 | CCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059222 | 76347 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 206 | 3 | 2 | 2 | 1.8 | CCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 24954572 | 69947 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 290 | 4 | 2 | 6 | 0.2 | CCc1cc(=O)oc2nc(OCC#CCCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939042 | 69947 | 0 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | ChEMBL | 290 | 4 | 2 | 6 | 0.2 | CCc1cc(=O)oc2nc(OCC#CCCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 44579646 | 186965 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 432 | 7 | 1 | 5 | 4.8 | Cc1c(C(=O)NCCOc2ccccc2F)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490413 | 186965 | 0 | None | - | 1 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 432 | 7 | 1 | 5 | 4.8 | Cc1c(C(=O)NCCOc2ccccc2F)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 13153555 | 93863 | 27 | None | 42 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247921 | 93863 | 27 | None | 42 | 2 | Human | 5.8 | pEC50 | = | 5.8 | Functional | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 676464 | 89876 | 75 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL237788 | 89876 | 75 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 44433529 | 88536 | 0 | None | -5 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 176 | 2 | 2 | 4 | 0.5 | c1c(-c2nnn[nH]2)n[nH]c1C1CC1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235230 | 88536 | 0 | None | -5 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 176 | 2 | 2 | 4 | 0.5 | c1c(-c2nnn[nH]2)n[nH]c1C1CC1 | 10.1016/j.bmcl.2007.07.101 | ||
| 46889397 | 6725 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 232 | 3 | 2 | 5 | 0.1 | COC[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083688 | 6725 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 232 | 3 | 2 | 5 | 0.1 | COC[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 44433530 | 147524 | 0 | None | -2 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 192 | 4 | 2 | 4 | 0.9 | CCCCc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL393065 | 147524 | 0 | None | -2 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 192 | 4 | 2 | 4 | 0.9 | CCCCc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 135416384 | 184824 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 382 | 5 | 3 | 5 | 3.1 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL485196 | 184824 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 382 | 5 | 3 | 5 | 3.1 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 15605645 | 75244 | 2 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 250 | 4 | 2 | 4 | 0.9 | CCCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036825 | 75244 | 2 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 250 | 4 | 2 | 4 | 0.9 | CCCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 57397199 | 69919 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 298 | 4 | 1 | 5 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccccc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939014 | 69919 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 298 | 4 | 1 | 5 | 2.0 | CCc1cc(=O)oc2nc(OCc3ccccc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 135899171 | 16170 | 0 | None | -18 | 3 | Rat | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224070 | 16170 | 0 | None | -18 | 3 | Rat | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 137661636 | 159263 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 331 | 4 | 2 | 2 | 3.5 | O=C(CCC#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4099238 | 159263 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 331 | 4 | 2 | 2 | 3.5 | O=C(CCC#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 137662135 | 159350 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 367 | 6 | 2 | 2 | 4.5 | O=C(CCc1ccc(-c2ccccc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4100231 | 159350 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 367 | 6 | 2 | 2 | 4.5 | O=C(CCc1ccc(-c2ccccc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 44579779 | 186895 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | COCC(NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C)c1ccccc1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL489787 | 186895 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | COCC(NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C)c1ccccc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 15986755 | 184118 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL482698 | 184118 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 16125020 | 137618 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 230 | 1 | 1 | 3 | 1.4 | O=C(O)C1=CC(=O)C2(CCc3ccccc32)O1 | 10.1021/jm070022x | ||
| CHEMBL375753 | 137618 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 230 | 1 | 1 | 3 | 1.4 | O=C(O)C1=CC(=O)C2(CCc3ccccc32)O1 | 10.1021/jm070022x | ||
| 57413546 | 76111 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 222 | 4 | 2 | 3 | 1.0 | CCOC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057607 | 76111 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 222 | 4 | 2 | 3 | 1.0 | CCOC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| 137645601 | 157851 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 299 | 6 | 2 | 2 | 3.2 | O=C(/C=C/CCc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4083723 | 157851 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 299 | 6 | 2 | 2 | 3.2 | O=C(/C=C/CCc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 57413542 | 76476 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 204 | 2 | 2 | 2 | 1.4 | O=C(O)c1n[nH]c2c1C[C@@H]1[C@H]2[C@@H]1C1CC1 | 10.1021/jm2010964 | ||
| CHEMBL2059829 | 76476 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 204 | 2 | 2 | 2 | 1.4 | O=C(O)c1n[nH]c2c1C[C@@H]1[C@H]2[C@@H]1C1CC1 | 10.1021/jm2010964 | ||
| 56950369 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 8469 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| CHEMBL2036958 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| DB12433 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 59343664 | 75256 | 0 | None | 1 | 4 | Rat | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036951 | 75256 | 0 | None | 1 | 4 | Rat | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 15604637 | 75260 | 0 | None | 1 | 3 | Rat | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036955 | 75260 | 0 | None | 1 | 3 | Rat | 8.7 | pEC50 | = | 8.7 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 11379903 | 84271 | 0 | None | 6 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm800896z | ||
| CHEMBL221282 | 84271 | 0 | None | 6 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm800896z | ||
| 11379903 | 84271 | 0 | None | 6 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL221282 | 84271 | 0 | None | 6 | 2 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 11206816 | 84907 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 222 | 2 | 1 | 3 | 1.8 | CC1(C2=CCCCC2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL223706 | 84907 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 222 | 2 | 1 | 3 | 1.8 | CC1(C2=CCCCC2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 136375465 | 177133 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 357 | 6 | 3 | 8 | 1.4 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4633857 | 177133 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 357 | 6 | 3 | 8 | 1.4 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 46889399 | 6833 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 242 | 1 | 2 | 4 | 1.4 | C1CCC2(C1)[C@H]1Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083990 | 6833 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 242 | 1 | 2 | 4 | 1.4 | C1CCC2(C1)[C@H]1Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 28400056 | 152223 | 1 | None | -74 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 208 | 5 | 2 | 3 | 2.4 | CCC(CC)Nc1ccc(C(=O)O)cn1 | 10.1016/j.bmcl.2007.09.058 | ||
| CHEMBL396879 | 152223 | 1 | None | -74 | 2 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 208 | 5 | 2 | 3 | 2.4 | CCC(CC)Nc1ccc(C(=O)O)cn1 | 10.1016/j.bmcl.2007.09.058 | ||
| 57398904 | 69922 | 1 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 280 | 6 | 1 | 6 | 0.9 | CCOCCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939017 | 69922 | 1 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 280 | 6 | 1 | 6 | 0.9 | CCOCCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 11672811 | 1001 | 5 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 10.1016/j.bmcl.2010.03.062 | ||
| 5790 | 1001 | 5 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1169573 | 1001 | 5 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 10.1016/j.bmcl.2010.03.062 | ||
| 11311474 | 165782 | 0 | None | 1 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2ccc(Cl)s2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL424750 | 165782 | 0 | None | 1 | 2 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2ccc(Cl)s2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 24741306 | 166956 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 334 | 6 | 3 | 2 | 4.0 | O=C(CCc1ccc(-c2ccc[nH]2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL428724 | 166956 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 334 | 6 | 3 | 2 | 4.0 | O=C(CCc1ccc(-c2ccc[nH]2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 44579761 | 187158 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | Cc1ccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)cc1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL492019 | 187158 | 0 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 4.9 | Cc1ccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)cc1 | 10.1016/j.bmcl.2008.08.039 | ||
| 44441322 | 147563 | 1 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 196 | 3 | 2 | 3 | 1.5 | CCCC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL393086 | 147563 | 1 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 196 | 3 | 2 | 3 | 1.5 | CCCC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 145985690 | 165443 | 0 | None | -17 | 3 | Rat | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 464 | 5 | 2 | 7 | 3.9 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)CCCC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| CHEMBL4239086 | 165443 | 0 | None | -17 | 3 | Rat | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 464 | 5 | 2 | 7 | 3.9 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3c(s2)CCCC3)cc1N1CCOCC1 | 10.1021/acs.jmedchem.7b00718 | ||
| 57412211 | 76116 | 1 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2c3[nH]nc(C(=O)O)c3C[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057617 | 76116 | 1 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2c3[nH]nc(C(=O)O)c3C[C@@H]21 | 10.1021/jm2010964 | ||
| 53238781 | 1027 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 5789 | 1027 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770358 | 1027 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| 24953854 | 69952 | 0 | None | 1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 328 | 5 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCC3CCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939047 | 69952 | 0 | None | 1 | 2 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 328 | 5 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCC3CCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 46890539 | 7040 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 472 | 7 | 2 | 6 | 3.9 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084841 | 7040 | 0 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 472 | 7 | 2 | 6 | 3.9 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 57412216 | 76118 | 1 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057619 | 76118 | 1 | None | - | 1 | Human | 7.7 | pEC50 | = | 7.7 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 59304931 | 75236 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 222 | 1 | 2 | 4 | 0.3 | CC(C)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036814 | 75236 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 222 | 1 | 2 | 4 | 0.3 | CC(C)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 44441326 | 150178 | 5 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 170 | 1 | 2 | 3 | 0.8 | O=C(O)c1[nH]nc2c1SCC2 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL395177 | 150178 | 5 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 170 | 1 | 2 | 3 | 0.8 | O=C(O)c1[nH]nc2c1SCC2 | 10.1016/j.bmcl.2007.06.028 | ||
| 16048921 | 155017 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 366 | 3 | 2 | 5 | 2.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nc3ccccc3o2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL401470 | 155017 | 0 | None | - | 1 | Human | 4.7 | pEC50 | = | 4.7 | Functional | ChEMBL | 366 | 3 | 2 | 5 | 2.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nc3ccccc3o2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 44441302 | 93355 | 23 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 166 | 2 | 2 | 2 | 1.4 | O=C(O)c1cc(C2CCC2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL245491 | 93355 | 23 | None | - | 1 | Human | 5.7 | pEC50 | = | 5.7 | Functional | ChEMBL | 166 | 2 | 2 | 2 | 1.4 | O=C(O)c1cc(C2CCC2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 57413447 | 76349 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 220 | 4 | 2 | 2 | 2.2 | CCCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059224 | 76349 | 0 | None | - | 1 | Human | 6.7 | pEC50 | = | 6.7 | Functional | ChEMBL | 220 | 4 | 2 | 2 | 2.2 | CCCC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 57412300 | 76475 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 204 | 3 | 2 | 2 | 1.6 | C=CC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2059828 | 76475 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 204 | 3 | 2 | 2 | 1.6 | C=CC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 46890537 | 7038 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 7 | 2 | 6 | 3.8 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084839 | 7038 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 7 | 2 | 6 | 3.8 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 59304949 | 75249 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 1.1 | CCCC(C)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036830 | 75249 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 1.1 | CCCC(C)c1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 137647495 | 157856 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4083762 | 157856 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11159621 | 2548 | 46 | None | -1 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 5784 | 2548 | 46 | None | -1 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL456145 | 2548 | 46 | None | -1 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| DB05939 | 2548 | 46 | None | -1 | 3 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 11159621 | 2548 | 46 | None | -2 | 3 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 5784 | 2548 | 46 | None | -2 | 3 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL456145 | 2548 | 46 | None | -2 | 3 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| DB05939 | 2548 | 46 | None | -2 | 3 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 44579648 | 186966 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 448 | 7 | 1 | 5 | 5.3 | Cc1c(C(=O)NCCOc2ccc(Cl)cc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490414 | 186966 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 448 | 7 | 1 | 5 | 5.3 | Cc1c(C(=O)NCCOc2ccc(Cl)cc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 44580036 | 187101 | 1 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 464 | 7 | 1 | 5 | 5.8 | Cc1c(C(=O)NCCOc2ccc3ccccc3c2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL491439 | 187101 | 1 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 464 | 7 | 1 | 5 | 5.8 | Cc1c(C(=O)NCCOc2ccc3ccccc3c2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 12003791 | 194829 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1237147 | 194829 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL539398 | 194829 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 11390981 | 136550 | 1 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 248 | 3 | 1 | 4 | 1.5 | COc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| CHEMBL373752 | 136550 | 1 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 248 | 3 | 1 | 4 | 1.5 | COc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| 2761046 | 148783 | 125 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1ccnnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394068 | 148783 | 125 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1ccnnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 46889362 | 7184 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 244 | 3 | 2 | 4 | 1.5 | CC(C)C[C@H]1C2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085538 | 7184 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 244 | 3 | 2 | 4 | 1.5 | CC(C)C[C@H]1C2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 145949989 | 162960 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4174798 | 162960 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 145949989 | 162960 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4174798 | 162960 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 46889320 | 6654 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 202 | 1 | 2 | 4 | 0.5 | C[C@@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083380 | 6654 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 202 | 1 | 2 | 4 | 0.5 | C[C@@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 57390148 | 69932 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 399 | 5 | 1 | 6 | 3.6 | CCc1cc(=O)oc2nc(OCc3ccccc3-c3cccc(C#N)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939027 | 69932 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 399 | 5 | 1 | 6 | 3.6 | CCc1cc(=O)oc2nc(OCc3ccccc3-c3cccc(C#N)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 42625218 | 184179 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 398 | 5 | 3 | 5 | 3.8 | O=C(CCc1noc2c1ccc1c(F)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL483140 | 184179 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 398 | 5 | 3 | 5 | 3.8 | O=C(CCc1noc2c1ccc1c(F)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | ||
| 9822 | 145638 | 133 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL391574 | 145638 | 133 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 11436345 | 143 | 0 | None | 1 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 1599 | 143 | 0 | None | 1 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| CHEMBL424938 | 143 | 0 | None | 1 | 2 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 24741312 | 89399 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 2.3 | O=C(CCc1cnc(-n2cc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL237036 | 89399 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 358 | 6 | 3 | 7 | 2.3 | O=C(CCc1cnc(-n2cc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 135416394 | 2560 | 52 | None | -15 | 3 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 5788 | 2560 | 52 | None | -15 | 3 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 73755154 | 2560 | 52 | None | -15 | 3 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| CHEMBL1086657 | 2560 | 52 | None | -15 | 3 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 11183678 | 84772 | 1 | None | 1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 1.5 | CC1(c2ccsc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL223140 | 84772 | 1 | None | 1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 1.5 | CC1(c2ccsc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 11148966 | 1122 | 4 | None | -4 | 2 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 232 | 3 | 1 | 3 | 1.9 | CCC1(OC(=CC1=O)C(=O)O)c1ccccc1 | 10.1021/jm070022x | ||
| 1598 | 1122 | 4 | None | -4 | 2 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 232 | 3 | 1 | 3 | 1.9 | CCC1(OC(=CC1=O)C(=O)O)c1ccccc1 | 10.1021/jm070022x | ||
| CHEMBL436301 | 1122 | 4 | None | -4 | 2 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 232 | 3 | 1 | 3 | 1.9 | CCC1(OC(=CC1=O)C(=O)O)c1ccccc1 | 10.1021/jm070022x | ||
| 46889336 | 7064 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 202 | 1 | 2 | 4 | 0.5 | C[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1084950 | 7064 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 202 | 1 | 2 | 4 | 0.5 | C[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 24955288 | 58055 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 270 | 4 | 1 | 4 | 2.2 | CCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672750 | 58055 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 270 | 4 | 1 | 4 | 2.2 | CCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 46889363 | 7185 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 244 | 3 | 2 | 4 | 1.5 | CC(C)C[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085539 | 7185 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 244 | 3 | 2 | 4 | 1.5 | CC(C)C[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 57412302 | 76108 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 208 | 3 | 2 | 3 | 0.6 | COC[C@@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057604 | 76108 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 208 | 3 | 2 | 3 | 0.6 | COC[C@@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@@H]12 | 10.1021/jm2010964 | ||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | ||
| 46890538 | 7039 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 469 | 7 | 3 | 7 | 2.7 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084840 | 7039 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 469 | 7 | 3 | 7 | 2.7 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 137632012 | 156656 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4069406 | 156656 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11413114 | 137619 | 0 | None | 2 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 208 | 2 | 1 | 3 | 1.4 | CC1(C2=CCCC2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL375754 | 137619 | 0 | None | 2 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 208 | 2 | 1 | 3 | 1.4 | CC1(C2=CCCC2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 135899325 | 16193 | 0 | None | 1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224147 | 16193 | 0 | None | 1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 44441311 | 93667 | 49 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 142 | 2 | 3 | 3 | -0.4 | O=C(O)c1cc(CO)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL246903 | 93667 | 49 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 142 | 2 | 3 | 3 | -0.4 | O=C(O)c1cc(CO)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 44441320 | 147562 | 2 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 168 | 1 | 2 | 3 | 0.7 | CC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL393085 | 147562 | 2 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 168 | 1 | 2 | 3 | 0.7 | CC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 12003790 | 196055 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 276 | 2 | 2 | 2 | 3.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1Cl)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL560406 | 196055 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 276 | 2 | 2 | 2 | 3.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1Cl)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 17688981 | 147517 | 46 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 160 | 1 | 2 | 2 | 1.1 | Cc1[nH]nc(C(=O)O)c1Cl | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL393062 | 147517 | 46 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 160 | 1 | 2 | 2 | 1.1 | Cc1[nH]nc(C(=O)O)c1Cl | 10.1016/j.bmcl.2007.07.101 | ||
| 57400599 | 69948 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 304 | 5 | 2 | 6 | 0.6 | CCc1cc(=O)oc2nc(OCC#CCCCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939043 | 69948 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 304 | 5 | 2 | 6 | 0.6 | CCc1cc(=O)oc2nc(OCC#CCCCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 15604644 | 75242 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 304 | 4 | 2 | 5 | 1.4 | O=c1[nH]c(=O)c2c(CCCc3cccs3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036823 | 75242 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 304 | 4 | 2 | 5 | 1.4 | O=c1[nH]c(=O)c2c(CCCc3cccs3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 57393656 | 69925 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 264 | 4 | 1 | 5 | 1.5 | COc1nc2oc(=O)cc(CCC(C)C)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939020 | 69925 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 264 | 4 | 1 | 5 | 1.5 | COc1nc2oc(=O)cc(CCC(C)C)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 137637662 | 156241 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 383 | 6 | 3 | 3 | 4.2 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4064786 | 156241 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 383 | 6 | 3 | 3 | 4.2 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11817645 | 84906 | 1 | None | 12 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2cc(F)cc(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL223700 | 84906 | 1 | None | 12 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2cc(F)cc(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 42625382 | 184812 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 416 | 5 | 3 | 5 | 3.7 | Cn1c(=O)c2cc(O)ccc2c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc21 | 10.1021/jm900151e | ||
| CHEMBL485184 | 184812 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 416 | 5 | 3 | 5 | 3.7 | Cn1c(=O)c2cc(O)ccc2c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc21 | 10.1021/jm900151e | ||
| 156012920 | 177449 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 433 | 8 | 3 | 8 | 3.0 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccncc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4638809 | 177449 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 433 | 8 | 3 | 8 | 3.0 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccncc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 90645412 | 112415 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 365 | 6 | 2 | 4 | 3.4 | COc1ccc(/C=C/C(=O)NC2=C(C(=O)O)CCCC2)c(Cl)c1OC | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3297797 | 112415 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 365 | 6 | 2 | 4 | 3.4 | COc1ccc(/C=C/C(=O)NC2=C(C(=O)O)CCCC2)c(Cl)c1OC | 10.1016/j.bmc.2014.05.011 | ||
| 46890400 | 7286 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1cc(C2CCC(NC(=O)CCc3ccc4cc(O)ccc4c3)=C(C(=O)O)C2)cn1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086030 | 7286 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1cc(C2CCC(NC(=O)CCc3ccc4cc(O)ccc4c3)=C(C(=O)O)C2)cn1 | 10.1016/j.bmcl.2010.04.001 | ||
| 44433525 | 147255 | 24 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 170 | 2 | 2 | 2 | 1.1 | O=C(O)c1n[nH]c(C2CC2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL392859 | 147255 | 24 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 170 | 2 | 2 | 2 | 1.1 | O=C(O)c1n[nH]c(C2CC2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.03.062 | ||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | ||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | ||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 135966934 | 6842 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 452 | 7 | 3 | 7 | 3.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084030 | 6842 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 452 | 7 | 3 | 7 | 3.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 11607970 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 10.1021/jm2010964 | ||
| 5785 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 10.1021/jm2010964 | ||
| CHEMBL2059221 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 10.1021/jm2010964 | ||
| 11646179 | 184813 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 359 | 5 | 3 | 3 | 4.0 | O=C(CCc1ccc2c(ccc3[nH]ncc32)c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL485185 | 184813 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 359 | 5 | 3 | 3 | 4.0 | O=C(CCc1ccc2c(ccc3[nH]ncc32)c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 57400595 | 69931 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3ccc(C(F)(F)F)cc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939026 | 69931 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3ccc(C(F)(F)F)cc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 117629482 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 1588 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 1594 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 2835 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 938 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| CHEMBL573 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| DB00627 | 2823 | 140 | None | 3 | 4 | Mouse | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | ||
| 137653026 | 158707 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 329 | 3 | 2 | 2 | 3.3 | O=C(/C=C/C#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4093294 | 158707 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 329 | 3 | 2 | 2 | 3.3 | O=C(/C=C/C#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 44351665 | 116846 | 26 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 154 | 1 | 2 | 3 | 0.1 | O=C(O)c1[nH]nc2c1COC2 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL338071 | 116846 | 26 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 154 | 1 | 2 | 3 | 0.1 | O=C(O)c1[nH]nc2c1COC2 | 10.1016/j.bmcl.2007.06.028 | ||
| 11494579 | 1058 | 0 | None | -123 | 2 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| 5791 | 1058 | 0 | None | -123 | 2 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| CHEMBL482768 | 1058 | 0 | None | -123 | 2 | Rat | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| 53324022 | 58051 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 1.6 | CCc1cc(=O)oc2nc(C(F)Cl)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672745 | 58051 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 1.6 | CCc1cc(=O)oc2nc(C(F)Cl)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 90645407 | 112519 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 356 | 4 | 2 | 3 | 3.9 | O=C(/C=C/c1cc2ccccc2nc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299016 | 112519 | 0 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 356 | 4 | 2 | 3 | 3.9 | O=C(/C=C/c1cc2ccccc2nc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 53324024 | 58058 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 284 | 4 | 1 | 4 | 2.4 | CC(C)CCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672753 | 58058 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 284 | 4 | 1 | 4 | 2.4 | CC(C)CCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 145960556 | 162222 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 3 | 1 | 6 | 4.9 | CCc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4163051 | 162222 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 3 | 1 | 6 | 4.9 | CCc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 46889342 | 7183 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 228 | 2 | 2 | 4 | 1.1 | C/C=C/[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085537 | 7183 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 228 | 2 | 2 | 4 | 1.1 | C/C=C/[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 57412400 | 76119 | 1 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057620 | 76119 | 1 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 145960556 | 162222 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 3 | 1 | 6 | 4.9 | CCc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4163051 | 162222 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 454 | 3 | 1 | 6 | 4.9 | CCc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 57413541 | 76474 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 204 | 3 | 2 | 2 | 1.6 | C=CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059827 | 76474 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 204 | 3 | 2 | 2 | 1.6 | C=CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 46890298 | 7162 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085414 | 7162 | 0 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 15605646 | 75245 | 1 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 264 | 5 | 2 | 4 | 1.3 | CCCCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036826 | 75245 | 1 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 264 | 5 | 2 | 4 | 1.3 | CCCCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 24953854 | 69952 | 0 | None | -1 | 2 | Rat | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 328 | 5 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCC3CCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939047 | 69952 | 0 | None | -1 | 2 | Rat | 7.6 | pEC50 | = | 7.6 | Functional | ChEMBL | 328 | 5 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCC3CCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 11218626 | 84892 | 0 | None | -1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1csc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| CHEMBL223623 | 84892 | 0 | None | -1 | 2 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1csc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| 156011372 | 177352 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 415 | 10 | 3 | 9 | 1.9 | COCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4637548 | 177352 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 415 | 10 | 3 | 9 | 1.9 | COCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 11557600 | 167382 | 1 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 1.8 | O=C(O)c1cc(Cc2cccc(F)c2)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL429495 | 167382 | 1 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 1.8 | O=C(O)c1cc(Cc2cccc(F)c2)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 12003699 | 196054 | 5 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 242 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL560405 | 196054 | 5 | None | - | 1 | Human | 4.6 | pEC50 | = | 4.6 | Functional | ChEMBL | 242 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 53326591 | 58040 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 314 | 5 | 1 | 4 | 2.6 | O=c1cc(CCCC2(F)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672645 | 58040 | 0 | None | - | 1 | Human | 6.6 | pEC50 | = | 6.6 | Functional | ChEMBL | 314 | 5 | 1 | 4 | 2.6 | O=c1cc(CCCC2(F)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 15605364 | 69918 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 262 | 4 | 1 | 5 | 1.2 | CCc1cc(=O)oc2nc(OCC3CC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939013 | 69918 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 262 | 4 | 1 | 5 | 1.2 | CCc1cc(=O)oc2nc(OCC3CC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 11159621 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.03.062 | ||
| 5784 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL456145 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.03.062 | ||
| DB05939 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.03.062 | ||
| 11159621 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm2010964 | ||
| 5784 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm2010964 | ||
| CHEMBL456145 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm2010964 | ||
| DB05939 | 2548 | 46 | None | -1 | 3 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm2010964 | ||
| 46889398 | 6832 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 216 | 1 | 2 | 4 | 0.9 | CC1(C)[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083989 | 6832 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 216 | 1 | 2 | 4 | 0.9 | CC1(C)[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 117629482 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 117629482 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1588 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1588 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1594 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1594 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 2835 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 2835 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 938 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 938 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| CHEMBL573 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| CHEMBL573 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| DB00627 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| DB00627 | 2823 | 140 | None | 3 | 4 | Mouse | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 11380943 | 83459 | 1 | None | 20 | 2 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 296 | 2 | 1 | 3 | 2.2 | CC1(c2cccc(Br)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL219980 | 83459 | 1 | None | 20 | 2 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 296 | 2 | 1 | 3 | 2.2 | CC1(c2cccc(Br)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 135416391 | 6920 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | ||
| CHEMBL1084393 | 6920 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | ||
| 135416393 | 7629 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | ||
| CHEMBL1088213 | 7629 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | ||
| 57400594 | 69930 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3cccc(C(F)(F)F)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939025 | 69930 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 366 | 4 | 1 | 5 | 3.0 | CCc1cc(=O)oc2nc(OCc3cccc(C(F)(F)F)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 136000579 | 61400 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770175 | 61400 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 59304795 | 75233 | 2 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 194 | 0 | 2 | 4 | -0.5 | Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036811 | 75233 | 2 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 194 | 0 | 2 | 4 | -0.5 | Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 156017210 | 177730 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 414 | 8 | 4 | 3 | 5.1 | CCCCc1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)[nH]1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4642367 | 177730 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 414 | 8 | 4 | 3 | 5.1 | CCCCc1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)[nH]1 | 10.1016/j.bmcl.2020.127105 | ||
| 78346 | 93750 | 133 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1cncnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247316 | 93750 | 133 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1cncnc1 | 10.1016/j.bmcl.2007.06.028 | ||
| 57402398 | 69934 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 5 | 1 | 7 | 2.6 | CCc1cc(=O)oc2nc(OCc3ccc(-c4cncnc4)cc3F)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939029 | 69934 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 394 | 5 | 1 | 7 | 2.6 | CCc1cc(=O)oc2nc(OCc3ccc(-c4cncnc4)cc3F)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 3159638 | 161911 | 61 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.0 | CCc1[nH]nc(C(=O)O)c1C | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL415261 | 161911 | 61 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.0 | CCc1[nH]nc(C(=O)O)c1C | 10.1016/j.bmcl.2007.07.101 | ||
| 136000718 | 61402 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770177 | 61402 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | ||
| 137655320 | 158538 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4091501 | 158538 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 59343664 | 75256 | 0 | None | -1 | 4 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036951 | 75256 | 0 | None | -1 | 4 | Human | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 51346919 | 57843 | 6 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1671877 | 57843 | 6 | None | 1 | 4 | Rat | 8.5 | pEC50 | = | 8.5 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 46890270 | 7375 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 395 | 8 | 3 | 3 | 4.9 | CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086354 | 7375 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 395 | 8 | 3 | 3 | 4.9 | CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 145949989 | 162960 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4174798 | 162960 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 145949989 | 162960 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4174798 | 162960 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 410 | 2 | 1 | 4 | 5.3 | Cc1ccc(-c2cc3cc(C4Nc5ccccc5C(=O)N4C)cc(C)c3oc2=O)cc1 | 10.1016/j.ejmech.2018.04.037 | ||
| 44579763 | 186983 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)N[C@@H](C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490600 | 186983 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)N[C@@H](C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 24955642 | 58057 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 298 | 6 | 1 | 4 | 2.9 | CCCCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672752 | 58057 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 298 | 6 | 1 | 4 | 2.9 | CCCCCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 46890297 | 7214 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085653 | 7214 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 15605287 | 75232 | 2 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 208 | 1 | 2 | 4 | -0.3 | CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036810 | 75232 | 2 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 208 | 1 | 2 | 4 | -0.3 | CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 70686047 | 75253 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CCC(C)Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036947 | 75253 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CCC(C)Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 53324033 | 58033 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 298 | 4 | 1 | 5 | 2.0 | CCc1cc(=O)oc2nc(COc3ccccc3)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672638 | 58033 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 298 | 4 | 1 | 5 | 2.0 | CCc1cc(=O)oc2nc(COc3ccccc3)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 57412214 | 76114 | 1 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057615 | 76114 | 1 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 53317467 | 58039 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 372 | 6 | 1 | 4 | 3.9 | O=c1cc(CCCC2(c3ccccc3)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672643 | 58039 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 372 | 6 | 1 | 4 | 3.9 | O=c1cc(CCCC2(c3ccccc3)CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 57390149 | 69946 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 276 | 3 | 2 | 6 | -0.2 | CCc1cc(=O)oc2nc(OCC#CCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939041 | 69946 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 276 | 3 | 2 | 6 | -0.2 | CCc1cc(=O)oc2nc(OCC#CCO)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 57390147 | 69924 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 290 | 4 | 1 | 5 | 2.0 | COc1nc2oc(=O)cc(CCC3CCCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939019 | 69924 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 290 | 4 | 1 | 5 | 2.0 | COc1nc2oc(=O)cc(CCC3CCCC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 136375437 | 178081 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 432 | 8 | 3 | 7 | 3.6 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccccc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4647670 | 178081 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 432 | 8 | 3 | 7 | 3.6 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccccc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 44580007 | 186947 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 366 | 6 | 1 | 5 | 3.6 | COCC(C)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490215 | 186947 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 366 | 6 | 1 | 5 | 3.6 | COCC(C)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | ||
| 54587625 | 61396 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 376 | 6 | 4 | 4 | 3.3 | N[C@@H](Cc1ccc(-c2ccc(O)cc2)cc1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770171 | 61396 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 376 | 6 | 4 | 4 | 3.3 | N[C@@H](Cc1ccc(-c2ccc(O)cc2)cc1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 53318746 | 58036 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 324 | 6 | 1 | 4 | 3.3 | CCC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| CHEMBL1672640 | 58036 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 324 | 6 | 1 | 4 | 3.3 | CCC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| 16048919 | 94683 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc12 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252708 | 94683 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc12 | 10.1016/j.bmcl.2007.10.055 | ||
| 11470032 | 84748 | 1 | None | - | 1 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 219 | 2 | 1 | 4 | 0.9 | CC1(c2cccnc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL222949 | 84748 | 1 | None | - | 1 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 219 | 2 | 1 | 4 | 0.9 | CC1(c2cccnc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 53326616 | 58050 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 0.9 | CCc1cc(=O)oc2nc(CF)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672744 | 58050 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 0.9 | CCc1cc(=O)oc2nc(CF)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 137659759 | 159267 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 314 | 4 | 3 | 4 | 1.9 | O=C(CCC#Cc1ccc(O)cn1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4099278 | 159267 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 314 | 4 | 3 | 4 | 1.9 | O=C(CCC#Cc1ccc(O)cn1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 53325309 | 58062 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 236 | 3 | 1 | 5 | 0.6 | CCc1cc(=O)oc2nc(COC)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672768 | 58062 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 236 | 3 | 1 | 5 | 0.6 | CCc1cc(=O)oc2nc(COC)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 11516324 | 184216 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 375 | 5 | 4 | 4 | 3.7 | O=C(CCc1[nH]nc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL483352 | 184216 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 375 | 5 | 4 | 4 | 3.7 | O=C(CCc1[nH]nc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 57398906 | 69944 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 286 | 3 | 1 | 5 | 1.2 | CCc1cc(=O)oc2nc(OCC#CC3CC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939039 | 69944 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | ChEMBL | 286 | 3 | 1 | 5 | 1.2 | CCc1cc(=O)oc2nc(OCC#CC3CC3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 11493732 | 193100 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL522649 | 193100 | 0 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 135899178 | 16210 | 0 | None | 2 | 2 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224219 | 16210 | 0 | None | 2 | 2 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 11610260 | 145949 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 364 | 6 | 2 | 4 | 4.2 | Cc1noc(C)c1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm700942d | ||
| CHEMBL391812 | 145949 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 364 | 6 | 2 | 4 | 4.2 | Cc1noc(C)c1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm700942d | ||
| 136088957 | 61403 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770178 | 61403 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | ||
| 44433534 | 152411 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 210 | 4 | 2 | 4 | 1.1 | CCCCc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL397056 | 152411 | 0 | None | - | 1 | Human | 5.5 | pEC50 | = | 5.5 | Functional | ChEMBL | 210 | 4 | 2 | 4 | 1.1 | CCCCc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 28400046 | 89810 | 3 | None | -32 | 2 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 194 | 4 | 2 | 3 | 1.8 | CC(C)CNc1ccc(C(=O)O)cn1 | 10.1016/j.bmcl.2007.09.058 | ||
| CHEMBL237737 | 89810 | 3 | None | -32 | 2 | Human | 4.5 | pEC50 | = | 4.5 | Functional | ChEMBL | 194 | 4 | 2 | 3 | 1.8 | CC(C)CNc1ccc(C(=O)O)cn1 | 10.1016/j.bmcl.2007.09.058 | ||
| 53318768 | 58049 | 1 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 242 | 2 | 1 | 4 | 1.4 | CCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672743 | 58049 | 1 | None | - | 1 | Human | 6.5 | pEC50 | = | 6.5 | Functional | ChEMBL | 242 | 2 | 1 | 4 | 1.4 | CCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 136088958 | 61446 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770353 | 61446 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 137639493 | 156911 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4072283 | 156911 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 90645405 | 112533 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299113 | 112533 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 90645414 | 112421 | 0 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 338 | 5 | 2 | 3 | 3.5 | Cc1ccc2cc(CCC(=O)NC3=C(C(=O)O)CCCC3)ccc2n1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3297874 | 112421 | 0 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 338 | 5 | 2 | 3 | 3.5 | Cc1ccc2cc(CCC(=O)NC3=C(C(=O)O)CCCC3)ccc2n1 | 10.1016/j.bmc.2014.05.011 | ||
| 57413367 | 76113 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057614 | 76113 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 11436345 | 143 | 0 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 1599 | 143 | 0 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| CHEMBL424938 | 143 | 0 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 11446592 | 149833 | 3 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 172 | 3 | 2 | 3 | 1.0 | CSCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394885 | 149833 | 3 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 172 | 3 | 2 | 3 | 1.0 | CSCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 46889364 | 7238 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 244 | 4 | 2 | 4 | 1.7 | CCCC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085760 | 7238 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 244 | 4 | 2 | 4 | 1.7 | CCCC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 53317492 | 58045 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 310 | 4 | 1 | 4 | 2.8 | CC1CC(CCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)C1 | 10.1021/ml100251u | ||
| CHEMBL1672737 | 58045 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 310 | 4 | 1 | 4 | 2.8 | CC1CC(CCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)C1 | 10.1021/ml100251u | ||
| 56659539 | 63818 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 337 | 5 | 3 | 4 | 3.3 | O=C(COc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm200371q | ||
| CHEMBL1802361 | 63818 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 337 | 5 | 3 | 4 | 3.3 | O=C(COc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm200371q | ||
| 11493732 | 193100 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL522649 | 193100 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | ||
| 12002802 | 195833 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 285 | 2 | 2 | 5 | 1.4 | Fc1ncccc1C1CCc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL558334 | 195833 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 285 | 2 | 2 | 5 | 1.4 | Fc1ncccc1C1CCc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.06.054 | ||
| 136088960 | 61448 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 373 | 6 | 4 | 8 | 0.7 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770355 | 61448 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 373 | 6 | 4 | 8 | 0.7 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | ||
| 59304954 | 75261 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036956 | 75261 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 117629482 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 117629482 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1588 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1588 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1594 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 1594 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 2835 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 2835 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 938 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| 938 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| CHEMBL573 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| CHEMBL573 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| DB00627 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml100251u | ||
| DB00627 | 2823 | 140 | None | -3 | 4 | Rat | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 137654580 | 159022 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4096635 | 159022 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 676464 | 89876 | 75 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL237788 | 89876 | 75 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 15604642 | 75254 | 0 | None | 1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CC(C)CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036948 | 75254 | 0 | None | 1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CC(C)CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 15604637 | 75260 | 0 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036955 | 75260 | 0 | None | -1 | 3 | Human | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 262 | 4 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCCC3CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 51346919 | 57843 | 6 | None | -1 | 4 | Mouse | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1671877 | 57843 | 6 | None | -1 | 4 | Mouse | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 59304608 | 75259 | 0 | None | -3 | 4 | Mouse | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036954 | 75259 | 0 | None | -3 | 4 | Mouse | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 15604642 | 75254 | 0 | None | -1 | 3 | Rat | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CC(C)CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036948 | 75254 | 0 | None | -1 | 3 | Rat | 8.4 | pEC50 | = | 8.4 | Functional | ChEMBL | 250 | 3 | 2 | 4 | 0.8 | CC(C)CCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 11501698 | 192570 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 376 | 5 | 3 | 6 | 2.9 | O=C(CCc1nnn2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL521326 | 192570 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 376 | 5 | 3 | 6 | 2.9 | O=C(CCc1nnn2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 1597 | 1965 | 80 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 205 | 2 | 1 | 4 | 1.7 | OC(=O)c1ccc2c(c1)nnn2C(C)C | 10.1021/jm800896z | ||
| 2736690 | 1965 | 80 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 205 | 2 | 1 | 4 | 1.7 | OC(=O)c1ccc2c(c1)nnn2C(C)C | 10.1021/jm800896z | ||
| CHEMBL381638 | 1965 | 80 | None | 1 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 205 | 2 | 1 | 4 | 1.7 | OC(=O)c1ccc2c(c1)nnn2C(C)C | 10.1021/jm800896z | ||
| 11159621 | 2548 | 46 | None | 1 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 5784 | 2548 | 46 | None | 1 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL456145 | 2548 | 46 | None | 1 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| DB05939 | 2548 | 46 | None | 1 | 3 | Mouse | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 11693991 | 88535 | 1 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 178 | 2 | 2 | 4 | 0.7 | CC(C)c1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235229 | 88535 | 1 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 178 | 2 | 2 | 4 | 0.7 | CC(C)c1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 24180571 | 89929 | 26 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 144 | 1 | 2 | 2 | 0.6 | Cc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL238004 | 89929 | 26 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 144 | 1 | 2 | 2 | 0.6 | Cc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 24811199 | 6601 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083139 | 6601 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 54584718 | 61451 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 374 | 6 | 2 | 6 | 2.5 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770359 | 61451 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 374 | 6 | 2 | 6 | 2.5 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| 137650474 | 157279 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccc2O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4076822 | 157279 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccc2O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 90645406 | 112422 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 388 | 6 | 2 | 4 | 3.9 | COc1ccc2nc(Cl)c(CCC(=O)NC3=C(C(=O)O)CCCC3)cc2c1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3297875 | 112422 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 388 | 6 | 2 | 4 | 3.9 | COc1ccc2nc(Cl)c(CCC(=O)NC3=C(C(=O)O)CCCC3)cc2c1 | 10.1016/j.bmc.2014.05.011 | ||
| 90645404 | 112518 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 322 | 4 | 2 | 3 | 3.3 | O=C(/C=C/c1ccc2ccccc2n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299009 | 112518 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 322 | 4 | 2 | 3 | 3.3 | O=C(/C=C/c1ccc2ccccc2n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 11323649 | 84749 | 0 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 286 | 2 | 1 | 3 | 2.8 | CC1(c2cc(Cl)ccc2Cl)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL222955 | 84749 | 0 | None | - | 1 | Human | 4.4 | pEC50 | = | 4.4 | Functional | ChEMBL | 286 | 2 | 1 | 3 | 2.8 | CC1(c2cc(Cl)ccc2Cl)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 53321368 | 58059 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 324 | 4 | 1 | 4 | 3.3 | O=c1cc(CCC2CCCCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672754 | 58059 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 324 | 4 | 1 | 4 | 3.3 | O=c1cc(CCC2CCCCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 57402397 | 69923 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 250 | 4 | 1 | 5 | 1.2 | CCCCc1cc(=O)oc2nc(OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939018 | 69923 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 250 | 4 | 1 | 5 | 1.2 | CCCCc1cc(=O)oc2nc(OC)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 136086829 | 7338 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 466 | 7 | 3 | 7 | 3.6 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cccc(F)c1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086225 | 7338 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 466 | 7 | 3 | 7 | 3.6 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cccc(F)c1 | 10.1016/j.bmcl.2010.04.001 | ||
| 11219885 | 83462 | 0 | None | 3 | 2 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 286 | 2 | 1 | 3 | 2.5 | CC1(c2cccc(C(F)(F)F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL220001 | 83462 | 0 | None | 3 | 2 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 286 | 2 | 1 | 3 | 2.5 | CC1(c2cccc(C(F)(F)F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 57397203 | 69955 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 274 | 4 | 1 | 5 | 1.2 | CC#CCCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939050 | 69955 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 274 | 4 | 1 | 5 | 1.2 | CC#CCCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 15605359 | 69941 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 260 | 3 | 1 | 5 | 0.8 | CC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939036 | 69941 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 260 | 3 | 1 | 5 | 0.8 | CC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 42625475 | 184209 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 414 | 5 | 3 | 5 | 4.3 | O=C(CCc1noc2c1ccc1c(Cl)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL483336 | 184209 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 414 | 5 | 3 | 5 | 4.3 | O=C(CCc1noc2c1ccc1c(Cl)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 57412216 | 76118 | 1 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057619 | 76118 | 1 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 192 | 2 | 2 | 2 | 1.4 | CC[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 11739420 | 84757 | 0 | None | 12 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 344 | 2 | 1 | 3 | 2.1 | CC1(c2cccc(I)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL223013 | 84757 | 0 | None | 12 | 2 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 344 | 2 | 1 | 3 | 2.1 | CC1(c2cccc(I)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 135800176 | 89400 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1cnc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL237037 | 89400 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1cnc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 46890268 | 6606 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 353 | 5 | 3 | 3 | 3.8 | CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083174 | 6606 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 353 | 5 | 3 | 3 | 3.8 | CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 44433526 | 88490 | 18 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 246 | 4 | 2 | 2 | 2.2 | CCCCc1[nH]nc(C(=O)O)c1Br | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235010 | 88490 | 18 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 246 | 4 | 2 | 2 | 2.2 | CCCCc1[nH]nc(C(=O)O)c1Br | 10.1016/j.bmcl.2007.07.101 | ||
| 16048768 | 94450 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(C(=O)Nc2ccccc2C(=O)O)[C@H](C)CN1c1cnc2ccccc2n1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL251222 | 94450 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(C(=O)Nc2ccccc2C(=O)O)[C@H](C)CN1c1cnc2ccccc2n1 | 10.1016/j.bmcl.2007.10.055 | ||
| 12003785 | 196379 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 260 | 2 | 2 | 2 | 2.5 | O=C(O)c1n[nH]c2c1CC(c1ccccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL562632 | 196379 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 260 | 2 | 2 | 2 | 2.5 | O=C(O)c1n[nH]c2c1CC(c1ccccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 53318741 | 58054 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 256 | 3 | 1 | 4 | 1.8 | CCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672749 | 58054 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 256 | 3 | 1 | 4 | 1.8 | CCCc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 46889319 | 7130 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 188 | 1 | 2 | 4 | 0.2 | C1c2c(-c3nnn[nH]3)n[nH]c2[C@H]2C[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085289 | 7130 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 188 | 1 | 2 | 4 | 0.2 | C1c2c(-c3nnn[nH]3)n[nH]c2[C@H]2C[C@@H]12 | 10.1016/j.bmcl.2010.03.062 | ||
| 11560300 | 88539 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL235256 | 88539 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 46890577 | 6672 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 490 | 7 | 2 | 6 | 4.0 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083442 | 6672 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | ChEMBL | 490 | 7 | 2 | 6 | 4.0 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 137640776 | 157004 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 313 | 3 | 2 | 2 | 2.8 | O=C(/C=C/C#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4073322 | 157004 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 313 | 3 | 2 | 2 | 2.8 | O=C(/C=C/C#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 90645403 | 112480 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 321 | 4 | 2 | 2 | 3.9 | O=C(/C=C/c1ccc2ccccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3298700 | 112480 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 321 | 4 | 2 | 2 | 3.9 | O=C(/C=C/c1ccc2ccccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 12003791 | 194829 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1237147 | 194829 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL539398 | 194829 | 0 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | ||
| 24955294 | 58042 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 282 | 4 | 1 | 4 | 2.2 | O=c1cc(CCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672733 | 58042 | 0 | None | - | 1 | Human | 6.4 | pEC50 | = | 6.4 | Functional | ChEMBL | 282 | 4 | 1 | 4 | 2.2 | O=c1cc(CCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 145957123 | 162017 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 440 | 2 | 1 | 6 | 4.7 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4159670 | 162017 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 440 | 2 | 1 | 6 | 4.7 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 145957123 | 162017 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 440 | 2 | 1 | 6 | 4.7 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| CHEMBL4159670 | 162017 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 440 | 2 | 1 | 6 | 4.7 | Cc1cc(C2Nc3ccccc3C(=O)N2C)cc2cc(-c3ccc4c(c3)OCO4)c(=O)oc12 | 10.1016/j.ejmech.2018.04.037 | ||
| 46890578 | 6391 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 505 | 7 | 3 | 7 | 3.0 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1082294 | 6391 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 505 | 7 | 3 | 7 | 3.0 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 44579647 | 193021 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 432 | 7 | 1 | 5 | 4.8 | Cc1c(C(=O)NCCOc2ccc(F)cc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL522281 | 193021 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 432 | 7 | 1 | 5 | 4.8 | Cc1c(C(=O)NCCOc2ccc(F)cc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 9822 | 145638 | 133 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL391574 | 145638 | 133 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 46890501 | 7246 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 375 | 6 | 3 | 7 | 1.2 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085816 | 7246 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 375 | 6 | 3 | 7 | 1.2 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 16048840 | 94044 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 391 | 3 | 2 | 5 | 3.1 | O=C(O)c1ccccc1NC(=O)N1CCCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL248851 | 94044 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 391 | 3 | 2 | 5 | 3.1 | O=C(O)c1ccccc1NC(=O)N1CCCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 135416394 | 2560 | 52 | None | -288 | 3 | Rat | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 5788 | 2560 | 52 | None | -288 | 3 | Rat | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 73755154 | 2560 | 52 | None | -288 | 3 | Rat | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| CHEMBL1086657 | 2560 | 52 | None | -288 | 3 | Rat | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | ||
| 11367769 | 136564 | 1 | None | - | 1 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 208 | 2 | 1 | 4 | 1.1 | CC1(c2ccco2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL373880 | 136564 | 1 | None | - | 1 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 208 | 2 | 1 | 4 | 1.1 | CC1(c2ccco2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 11379903 | 84271 | 0 | None | 6 | 2 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL221282 | 84271 | 0 | None | 6 | 2 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 59304594 | 75243 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 290 | 3 | 2 | 5 | 1.0 | O=c1[nH]c(=O)c2c(CCc3cccs3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036824 | 75243 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 290 | 3 | 2 | 5 | 1.0 | O=c1[nH]c(=O)c2c(CCc3cccs3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 135401973 | 1022 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | ||
| 5792 | 1022 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL398496 | 1022 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | ||
| 53322689 | 58060 | 1 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1672755 | 58060 | 1 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 59304859 | 75248 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 300 | 4 | 2 | 6 | -0.9 | CS(=O)(=O)CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036829 | 75248 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 300 | 4 | 2 | 6 | -0.9 | CS(=O)(=O)CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 53322689 | 58060 | 1 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672755 | 58060 | 1 | None | 1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 53321396 | 58044 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | O=c1cc(CCCC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672736 | 58044 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | O=c1cc(CCCC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 11483496 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 1589 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| CHEMBL375493 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 10.1021/jm070022x | ||
| 42625476 | 184210 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 379 | 5 | 3 | 5 | 3.2 | O=C(CCc1cnn2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL483337 | 184210 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 379 | 5 | 3 | 5 | 3.2 | O=C(CCc1cnn2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 11276453 | 84876 | 0 | None | -1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1ccc(C2(C)OC(C(=O)O)=CC2=O)s1 | 10.1021/jm070022x | ||
| CHEMBL223566 | 84876 | 0 | None | -1 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.8 | Cc1ccc(C2(C)OC(C(=O)O)=CC2=O)s1 | 10.1021/jm070022x | ||
| 46890399 | 7285 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086029 | 7285 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 156013148 | 177468 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 356 | 6 | 3 | 7 | 2.1 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4639053 | 177468 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 356 | 6 | 3 | 7 | 2.1 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 24955646 | 58034 | 0 | None | -8 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| CHEMBL1672639 | 58034 | 0 | None | -8 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| 46890500 | 7245 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 360 | 6 | 2 | 6 | 2.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085815 | 7245 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 360 | 6 | 2 | 6 | 2.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 44441305 | 150121 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 188 | 3 | 2 | 3 | -0.0 | C[S+]([O-])Cc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL395118 | 150121 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 188 | 3 | 2 | 3 | -0.0 | C[S+]([O-])Cc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 15604641 | 75255 | 1 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 264 | 4 | 2 | 4 | 1.1 | CC(C)CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036950 | 75255 | 1 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 264 | 4 | 2 | 4 | 1.1 | CC(C)CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 59343664 | 75256 | 0 | None | -2 | 4 | Mouse | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036951 | 75256 | 0 | None | -2 | 4 | Mouse | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 272 | 4 | 2 | 4 | 0.8 | O=c1[nH]c(=O)c2c(CCCC(F)F)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 59304608 | 75259 | 0 | None | -5 | 4 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036954 | 75259 | 0 | None | -5 | 4 | Rat | 8.3 | pEC50 | = | 8.3 | Functional | ChEMBL | 262 | 3 | 2 | 4 | 0.9 | O=c1[nH]c(=O)c2c(CCC3CCC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 135466520 | 184217 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 378 | 5 | 3 | 5 | 3.4 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL483353 | 184217 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 378 | 5 | 3 | 5 | 3.4 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 135899171 | 16170 | 0 | None | 18 | 3 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1224070 | 16170 | 0 | None | 18 | 3 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 776416 | 18938 | 108 | None | 5 | 2 | Mouse | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL128604 | 18938 | 108 | None | 5 | 2 | Mouse | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 11594881 | 88638 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL235740 | 88638 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 98845 | 93716 | 125 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 143 | 1 | 1 | 3 | 1.2 | Cc1ncc(C(=O)O)s1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247134 | 93716 | 125 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 143 | 1 | 1 | 3 | 1.2 | Cc1ncc(C(=O)O)s1 | 10.1016/j.bmcl.2007.06.028 | ||
| 136088959 | 61447 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 383 | 6 | 4 | 8 | 1.6 | CC(c1nc(-c2ccc(O)cn2)no1)[C@H](N)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770354 | 61447 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 383 | 6 | 4 | 8 | 1.6 | CC(c1nc(-c2ccc(O)cn2)no1)[C@H](N)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 11183677 | 83463 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 1.5 | CC1(c2cccs2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL220004 | 83463 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 224 | 2 | 1 | 4 | 1.5 | CC1(c2cccs2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | ||
| 16048839 | 155016 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 382 | 3 | 2 | 5 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nsc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL401469 | 155016 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 382 | 3 | 2 | 5 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nsc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 46889337 | 6723 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 216 | 2 | 2 | 4 | 0.9 | CC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1083682 | 6723 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 216 | 2 | 2 | 4 | 0.9 | CC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 46889340 | 7181 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 228 | 2 | 2 | 4 | 0.9 | C1CC1[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085535 | 7181 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 228 | 2 | 2 | 4 | 0.9 | C1CC1[C@@H]1[C@H]2Cc3c(-c4nnn[nH]4)n[nH]c3[C@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 42625379 | 192091 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 4.0 | O=C(CCc1noc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL520299 | 192091 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 376 | 5 | 3 | 5 | 4.0 | O=C(CCc1noc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm2010964 | ||
| 90645411 | 112423 | 0 | None | - | 1 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 317 | 5 | 2 | 4 | 2.4 | O=C(CCc1ccc2c(c1)OCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3297876 | 112423 | 0 | None | - | 1 | Human | 4.3 | pEC50 | = | 4.3 | Functional | ChEMBL | 317 | 5 | 2 | 4 | 2.4 | O=C(CCc1ccc2c(c1)OCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm070022x | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | ||
| 24954935 | 69943 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 288 | 4 | 1 | 5 | 1.6 | CCCC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939038 | 69943 | 0 | None | - | 1 | Human | 7.3 | pEC50 | = | 7.3 | Functional | ChEMBL | 288 | 4 | 1 | 5 | 1.6 | CCCC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 1596 | 260 | 96 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1021/jm070022x | ||
| 5310993 | 260 | 96 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1021/jm070022x | ||
| 76 | 260 | 96 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1021/jm070022x | ||
| CHEMBL345714 | 260 | 96 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1021/jm070022x | ||
| DB09055 | 260 | 96 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1021/jm070022x | ||
| 120232 | 153285 | 132 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 141 | 1 | 1 | 2 | 0.9 | O=C(O)c1cncc(F)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL397783 | 153285 | 132 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 141 | 1 | 1 | 2 | 0.9 | O=C(O)c1cncc(F)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| 46890296 | 7213 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 364 | 5 | 3 | 4 | 3.3 | N#CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085652 | 7213 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 364 | 5 | 3 | 4 | 3.3 | N#CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | ||
| 57412297 | 76472 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 2.0 | CC(C)C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059822 | 76472 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 2.0 | CC(C)C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 11638560 | 187043 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 334 | 5 | 3 | 3 | 3.7 | Nc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL491002 | 187043 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 334 | 5 | 3 | 3 | 3.7 | Nc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | ||
| 11345283 | 85011 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 232 | 2 | 1 | 3 | 1.8 | Cc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| CHEMBL223878 | 85011 | 1 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 232 | 2 | 1 | 3 | 1.8 | Cc1cccc(C2(C)OC(C(=O)O)=CC2=O)c1 | 10.1021/jm070022x | ||
| 11264843 | 137620 | 1 | None | 1 | 2 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2ccc(F)cc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL375762 | 137620 | 1 | None | 1 | 2 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2ccc(F)cc2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 46889341 | 7182 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 230 | 3 | 2 | 4 | 1.3 | CCC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| CHEMBL1085536 | 7182 | 0 | None | - | 1 | Human | 6.3 | pEC50 | = | 6.3 | Functional | ChEMBL | 230 | 3 | 2 | 4 | 1.3 | CCC[C@H]1[C@@H]2c3[nH]nc(-c4nnn[nH]4)c3C[C@@H]21 | 10.1016/j.bmcl.2010.03.062 | ||
| 57412218 | 76350 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 220 | 4 | 2 | 2 | 2.2 | CCCC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2059225 | 76350 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 220 | 4 | 2 | 2 | 2.2 | CCCC[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 52941721 | 54965 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1204125 | 54965 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | ||
| CHEMBL1615577 | 54965 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | ||
| 44441323 | 93833 | 10 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 170 | 1 | 2 | 3 | 0.9 | O=C(O)c1[nH]nc2c1CSC2 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247724 | 93833 | 10 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 170 | 1 | 2 | 3 | 0.9 | O=C(O)c1[nH]nc2c1CSC2 | 10.1016/j.bmcl.2007.06.028 | ||
| 44441312 | 93864 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 196 | 6 | 2 | 2 | 2.2 | CCCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247922 | 93864 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 196 | 6 | 2 | 2 | 2.2 | CCCCCCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 137648318 | 157632 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 341 | 5 | 3 | 3 | 2.5 | O=C(CCC#Cc1ccc(C(=O)O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4081260 | 157632 | 0 | None | - | 1 | Human | 5.3 | pEC50 | = | 5.3 | Functional | ChEMBL | 341 | 5 | 3 | 3 | 2.5 | O=C(CCC#Cc1ccc(C(=O)O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 44433524 | 152208 | 29 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 158 | 2 | 2 | 2 | 0.8 | CCc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL396864 | 152208 | 29 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 158 | 2 | 2 | 2 | 0.8 | CCc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 11380943 | 83459 | 1 | None | 20 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 296 | 2 | 1 | 3 | 2.2 | CC1(c2cccc(Br)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL219980 | 83459 | 1 | None | 20 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 296 | 2 | 1 | 3 | 2.2 | CC1(c2cccc(Br)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 11368347 | 84946 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2ccccc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL223754 | 84946 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 236 | 2 | 1 | 3 | 1.6 | CC1(c2ccccc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 57412214 | 76114 | 1 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057615 | 76114 | 1 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 178 | 1 | 2 | 2 | 1.0 | C[C@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@H]12 | 10.1021/jm2010964 | ||
| 135401975 | 94748 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccc(O)cc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL253128 | 94748 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccc(O)cc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 90645410 | 112534 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 315 | 4 | 2 | 4 | 2.5 | O=C(/C=C/c1ccc2c(c1)OCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299114 | 112534 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 315 | 4 | 2 | 4 | 2.5 | O=C(/C=C/c1ccc2c(c1)OCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 57391931 | 69938 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 1 | 7 | 2.1 | CCc1noc(CC)c1COc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939033 | 69938 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 1 | 7 | 2.1 | CCc1noc(CC)c1COc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 44433533 | 89190 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 194 | 2 | 2 | 4 | 0.6 | Fc1c(-c2nnn[nH]2)n[nH]c1C1CC1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL236728 | 89190 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 194 | 2 | 2 | 4 | 0.6 | Fc1c(-c2nnn[nH]2)n[nH]c1C1CC1 | 10.1016/j.bmcl.2007.07.101 | ||
| 51346919 | 57843 | 6 | None | -19 | 4 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1671877 | 57843 | 6 | None | -19 | 4 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 296 | 5 | 1 | 4 | 2.5 | O=c1cc(CCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 11617151 | 88639 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL235741 | 88639 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 11617151 | 88639 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL235741 | 88639 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 16048998 | 94632 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252307 | 94632 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 53324057 | 58047 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 310 | 6 | 1 | 4 | 2.9 | O=c1cc(CCCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672741 | 58047 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 310 | 6 | 1 | 4 | 2.9 | O=c1cc(CCCCC2CC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 135453098 | 88734 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL236162 | 88734 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 136086828 | 7193 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 502 | 7 | 3 | 7 | 3.9 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1085589 | 7193 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 502 | 7 | 3 | 7 | 3.9 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | ||
| 135453098 | 88734 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL236162 | 88734 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 56950369 | 3559 | 13 | None | -3 | 4 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 8469 | 3559 | 13 | None | -3 | 4 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| CHEMBL2036958 | 3559 | 13 | None | -3 | 4 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| DB12433 | 3559 | 13 | None | -3 | 4 | Mouse | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 24955646 | 58034 | 0 | None | 2 | 4 | Rat | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| CHEMBL1672639 | 58034 | 0 | None | 2 | 4 | Rat | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 310 | 5 | 1 | 4 | 2.9 | CC1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| 42625474 | 184178 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 380 | 5 | 3 | 5 | 3.6 | O=C(CCc1noc2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL483139 | 184178 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 380 | 5 | 3 | 5 | 3.6 | O=C(CCc1noc2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 11624691 | 7227 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1085711 | 7227 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 136127010 | 16086 | 11 | None | 9 | 2 | Rat | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| CHEMBL1223819 | 16086 | 11 | None | 9 | 2 | Rat | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | ||
| 882926 | 85607 | 13 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm700942d | ||
| CHEMBL228244 | 85607 | 13 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm700942d | ||
| 882926 | 85607 | 13 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm900151e | ||
| CHEMBL228244 | 85607 | 13 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 301 | 6 | 2 | 4 | 2.4 | COc1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1021/jm900151e | ||
| 44580008 | 186948 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 414 | 7 | 1 | 5 | 4.6 | Cc1c(C(=O)NCCOc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL490216 | 186948 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 414 | 7 | 1 | 5 | 4.6 | Cc1c(C(=O)NCCOc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 53318740 | 58052 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.5 | CCc1cc(=O)oc2nc(C(C)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672746 | 58052 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 238 | 2 | 1 | 4 | 1.5 | CCc1cc(=O)oc2nc(C(C)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 11322762 | 137602 | 1 | None | 5 | 2 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2c(F)cccc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL375625 | 137602 | 1 | None | 5 | 2 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2c(F)cccc2F)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 17925840 | 93621 | 17 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 140 | 2 | 2 | 3 | -0.1 | O=Cc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL246692 | 93621 | 17 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 140 | 2 | 2 | 3 | -0.1 | O=Cc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 70683894 | 75241 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 298 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCc3ccccc3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036822 | 75241 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 298 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCc3ccccc3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 15986930 | 184910 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 3 | 6 | 2.8 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | ||
| CHEMBL485327 | 184910 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 371 | 5 | 3 | 6 | 2.8 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | ||
| 11776293 | 149257 | 8 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394441 | 149257 | 8 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 56950649 | 69937 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 331 | 5 | 1 | 7 | 1.9 | CCc1noc(C)c1COc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939032 | 69937 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 331 | 5 | 1 | 7 | 1.9 | CCc1noc(C)c1COc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 137653428 | 158543 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccc(F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4091542 | 158543 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccc(F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 44445341 | 154248 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 376 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)C1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL398625 | 154248 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 376 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)C1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 90645409 | 112532 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 386 | 5 | 2 | 4 | 3.9 | COc1ccc2nc(Cl)c(/C=C/C(=O)NC3=C(C(=O)O)CCCC3)cc2c1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299112 | 112532 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 386 | 5 | 2 | 4 | 3.9 | COc1ccc2nc(Cl)c(/C=C/C(=O)NC3=C(C(=O)O)CCCC3)cc2c1 | 10.1016/j.bmc.2014.05.011 | ||
| 1047 | 202636 | 130 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1cnccn1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL613 | 202636 | 130 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 124 | 1 | 1 | 3 | 0.2 | O=C(O)c1cnccn1 | 10.1016/j.bmcl.2007.06.028 | ||
| 11494579 | 1058 | 0 | None | 123 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| 5791 | 1058 | 0 | None | 123 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| CHEMBL482768 | 1058 | 0 | None | 123 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | ||
| 24811550 | 6680 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083450 | 6680 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 156021045 | 178131 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4648435 | 178131 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 135887289 | 6921 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | ||
| CHEMBL1084394 | 6921 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | ||
| 54580748 | 61398 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(CCc1cc2n(n1)-c1ccc(O)cc1CC2)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770173 | 61398 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(CCc1cc2n(n1)-c1ccc(O)cc1CC2)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 53321367 | 58053 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 228 | 1 | 1 | 4 | 1.1 | Cc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| CHEMBL1672748 | 58053 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 228 | 1 | 1 | 4 | 1.1 | Cc1cc(=O)oc2nc(C(F)F)[nH]c(=O)c12 | 10.1021/ml100251u | ||
| 11379903 | 84271 | 0 | None | 6 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL221282 | 84271 | 0 | None | 6 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 258 | 2 | 1 | 4 | 2.2 | CC1(c2csc(Cl)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 24953855 | 69950 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 316 | 5 | 1 | 5 | 2.3 | CCC#CCOc1nc2oc(=O)cc(CCC(C)C)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939045 | 69950 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 316 | 5 | 1 | 5 | 2.3 | CCC#CCOc1nc2oc(=O)cc(CCC(C)C)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 44441316 | 93790 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 194 | 3 | 2 | 2 | 1.9 | CCCC1CCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247526 | 93790 | 1 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 194 | 3 | 2 | 2 | 1.9 | CCCC1CCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 24953853 | 69954 | 0 | None | 1 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 328 | 6 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939049 | 69954 | 0 | None | 1 | 2 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 328 | 6 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 117629482 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 1588 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 1594 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 2835 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 938 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| CHEMBL573 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| DB00627 | 2823 | 140 | None | -3 | 4 | Rat | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | ||
| 90645408 | 112535 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 329 | 4 | 2 | 4 | 2.5 | O=C(/C=C/c1ccc2c(c1)OCCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3299115 | 112535 | 0 | None | - | 1 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 329 | 4 | 2 | 4 | 2.5 | O=C(/C=C/c1ccc2c(c1)OCCO2)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 42625213 | 192303 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 365 | 5 | 2 | 5 | 3.8 | O=C(CCc1cn2c(n1)sc1ccccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL520620 | 192303 | 0 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 365 | 5 | 2 | 5 | 3.8 | O=C(CCc1cn2c(n1)sc1ccccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 59343597 | 75265 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 296 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCC3(Cl)CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| CHEMBL2036960 | 75265 | 0 | None | - | 1 | Human | 8.2 | pEC50 | = | 8.2 | Functional | ChEMBL | 296 | 4 | 2 | 4 | 1.3 | O=c1[nH]c(=O)c2c(CCCC3(Cl)CC3)cc(=O)oc2[nH]1 | 10.1021/ml200243g | ||
| 57412301 | 76106 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 218 | 3 | 2 | 2 | 1.8 | O=C(O)c1n[nH]c2c1C[C@H]1[C@@H](CC3CC3)[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057602 | 76106 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 218 | 3 | 2 | 2 | 1.8 | O=C(O)c1n[nH]c2c1C[C@H]1[C@@H](CC3CC3)[C@@H]21 | 10.1021/jm2010964 | ||
| 122181142 | 121830 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL3589836 | 121830 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 44579762 | 187159 | 1 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)NC(C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL492020 | 187159 | 1 | None | - | 1 | Human | 6.2 | pEC50 | = | 6.2 | Functional | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)NC(C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | ||
| 11415838 | 136357 | 0 | None | 1 | 2 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 316 | 2 | 1 | 4 | 2.6 | Cc1sc(C2(C)OC(C(=O)O)=CC2=O)cc1Br | 10.1021/jm070022x | ||
| CHEMBL373484 | 136357 | 0 | None | 1 | 2 | Human | 5.2 | pEC50 | = | 5.2 | Functional | ChEMBL | 316 | 2 | 1 | 4 | 2.6 | Cc1sc(C2(C)OC(C(=O)O)=CC2=O)cc1Br | 10.1021/jm070022x | ||
| 137661033 | 159487 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4101720 | 159487 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 11470798 | 137967 | 1 | None | 2 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2ccc(F)c(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL376419 | 137967 | 1 | None | 2 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 254 | 2 | 1 | 3 | 1.7 | CC1(c2ccc(F)c(F)c2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 156020475 | 178074 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 3 | 5 | 4.5 | CCCCc1nc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1C | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4647545 | 178074 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 429 | 8 | 3 | 5 | 4.5 | CCCCc1nc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1C | 10.1016/j.bmcl.2020.127105 | ||
| 136088961 | 61450 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | CC1CCC(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770357 | 61450 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | CC1CCC(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| 57397202 | 69933 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 399 | 5 | 1 | 6 | 3.6 | CCc1cc(=O)oc2nc(OCc3cccc(-c4cccc(C#N)c4)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939028 | 69933 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 399 | 5 | 1 | 6 | 3.6 | CCc1cc(=O)oc2nc(OCc3cccc(-c4cccc(C#N)c4)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 135887288 | 7616 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | ||
| CHEMBL1088074 | 7616 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | ||
| 135922719 | 184287 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 3.0 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1C2 | 10.1021/jm900151e | ||
| CHEMBL483996 | 184287 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 377 | 5 | 3 | 5 | 3.0 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1C2 | 10.1021/jm900151e | ||
| 15605503 | 69935 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 299 | 4 | 1 | 6 | 1.4 | CCc1cc(=O)oc2nc(OCc3cccnc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939030 | 69935 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 299 | 4 | 1 | 6 | 1.4 | CCc1cc(=O)oc2nc(OCc3cccnc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 135502978 | 191989 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 377 | 5 | 4 | 4 | 3.2 | O=C(CCc1[nH]nc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| CHEMBL520136 | 191989 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 377 | 5 | 4 | 4 | 3.2 | O=C(CCc1[nH]nc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | ||
| 11324121 | 84666 | 0 | None | 5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | CC1(c2cc(Br)cs2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| CHEMBL222472 | 84666 | 0 | None | 5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 302 | 2 | 1 | 4 | 2.3 | CC1(c2cc(Br)cs2)OC(C(=O)O)=CC1=O | 10.1021/jm070022x | ||
| 46890579 | 7016 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 455 | 7 | 2 | 7 | 3.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084798 | 7016 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 455 | 7 | 2 | 7 | 3.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 46890580 | 7017 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 504 | 7 | 2 | 6 | 4.3 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084799 | 7017 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 504 | 7 | 2 | 6 | 4.3 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | ||
| 44433532 | 152409 | 0 | None | 16 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 182 | 2 | 2 | 4 | 0.3 | CCc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL397055 | 152409 | 0 | None | 16 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 182 | 2 | 2 | 4 | 0.3 | CCc1[nH]nc(-c2nnn[nH]2)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 15986931 | 192236 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 385 | 5 | 3 | 6 | 3.2 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| CHEMBL520513 | 192236 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 385 | 5 | 3 | 6 | 3.2 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | ||
| 15986755 | 184118 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL482698 | 184118 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 156021546 | 178186 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 401 | 9 | 4 | 9 | 1.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4649305 | 178186 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 401 | 9 | 4 | 9 | 1.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 247986 | 150180 | 129 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 157 | 1 | 1 | 2 | 1.4 | O=C(O)c1cncc(Cl)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL395178 | 150180 | 129 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 157 | 1 | 1 | 2 | 1.4 | O=C(O)c1cncc(Cl)c1 | 10.1016/j.bmcl.2007.06.028 | ||
| 11647028 | 88682 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 401 | 6 | 3 | 4 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL235954 | 88682 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 401 | 6 | 3 | 4 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 574310 | 18956 | 148 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 112 | 1 | 2 | 2 | 0.1 | O=C(O)c1cc[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL128679 | 18956 | 148 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 112 | 1 | 2 | 2 | 0.1 | O=C(O)c1cc[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| 44433528 | 147522 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 178 | 3 | 2 | 4 | 0.5 | CCCc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL393064 | 147522 | 0 | None | -10 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 178 | 3 | 2 | 4 | 0.5 | CCCc1cc(-c2nnn[nH]2)n[nH]1 | 10.1016/j.bmcl.2007.07.101 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml3000676 | ||
| 16048993 | 168977 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ncc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL439060 | 168977 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ncc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 53324034 | 58037 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 338 | 6 | 1 | 4 | 3.6 | CC(C)C1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| CHEMBL1672641 | 58037 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 338 | 6 | 1 | 4 | 3.6 | CC(C)C1(CCCc2cc(=O)oc3nc(C(F)F)[nH]c(=O)c23)CC1 | 10.1021/ml100251u | ||
| 10197980 | 88489 | 2 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 186 | 4 | 2 | 2 | 1.6 | CCCCc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL235009 | 88489 | 2 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 186 | 4 | 2 | 2 | 1.6 | CCCCc1[nH]nc(C(=O)O)c1F | 10.1016/j.bmcl.2007.07.101 | ||
| 4913402 | 149322 | 74 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 140 | 2 | 2 | 2 | 0.7 | CCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL394498 | 149322 | 74 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 140 | 2 | 2 | 2 | 0.7 | CCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.07.101 | ||
| 16048845 | 167175 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 420 | 4 | 3 | 6 | 1.8 | NC(=O)c1ccc2ncc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)nc2c1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL429120 | 167175 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 420 | 4 | 3 | 6 | 1.8 | NC(=O)c1ccc2ncc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)nc2c1 | 10.1016/j.bmcl.2007.10.055 | ||
| 56950369 | 3559 | 13 | None | -3 | 4 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 8469 | 3559 | 13 | None | -3 | 4 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| CHEMBL2036958 | 3559 | 13 | None | -3 | 4 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| DB12433 | 3559 | 13 | None | -3 | 4 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 10.1021/ml200243g | ||
| 15605571 | 75235 | 2 | None | 1 | 5 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036813 | 75235 | 2 | None | 1 | 5 | Rat | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.07.101 | ||
| 137635425 | 155922 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 331 | 4 | 3 | 3 | 2.7 | O=C(CCC#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4060899 | 155922 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 331 | 4 | 3 | 3 | 2.7 | O=C(CCC#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 4913402 | 149322 | 74 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 140 | 2 | 2 | 2 | 0.7 | CCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394498 | 149322 | 74 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 140 | 2 | 2 | 2 | 0.7 | CCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 57413450 | 76471 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 2.0 | CC(C)C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2059821 | 76471 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 2.0 | CC(C)C[C@@H]1[C@@H]2Cc3c(C(=O)O)n[nH]c3[C@@H]21 | 10.1021/jm2010964 | ||
| 156022048 | 178201 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 383 | 7 | 3 | 8 | 2.2 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(C2CC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4649587 | 178201 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 383 | 7 | 3 | 8 | 2.2 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(C2CC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | ||
| 53317491 | 58043 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 282 | 3 | 1 | 4 | 2.2 | O=c1cc(CC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| CHEMBL1672735 | 58043 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 282 | 3 | 1 | 4 | 2.2 | O=c1cc(CC2CCC2)c2c(=O)[nH]c(C(F)F)nc2o1 | 10.1021/ml100251u | ||
| 57413545 | 76109 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 224 | 3 | 2 | 3 | 1.4 | CSC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057605 | 76109 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 224 | 3 | 2 | 3 | 1.4 | CSC[C@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@H]21 | 10.1021/jm2010964 | ||
| 24953853 | 69954 | 0 | None | -1 | 2 | Rat | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 328 | 6 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939049 | 69954 | 0 | None | -1 | 2 | Rat | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 328 | 6 | 1 | 5 | 2.4 | CCC#CCOc1nc2oc(=O)cc(CCCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 11845295 | 149578 | 42 | None | 1 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1021/jm800258p | ||
| CHEMBL394688 | 149578 | 42 | None | 1 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1021/jm800258p | ||
| 15986754 | 184490 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 323 | 5 | 2 | 2 | 3.8 | O=C(CCc1ccc2ccccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL484719 | 184490 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 323 | 5 | 2 | 2 | 3.8 | O=C(CCc1ccc2ccccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 776421 | 89928 | 108 | None | 30 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL238002 | 89928 | 108 | None | 30 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 11845295 | 149578 | 42 | None | 1 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL394688 | 149578 | 42 | None | 1 | 2 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 166 | 1 | 2 | 2 | 1.2 | CC1CCc2c(C(=O)O)n[nH]c21 | 10.1016/j.bmcl.2007.06.028 | ||
| 135922722 | 184191 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1CC2 | 10.1021/jm900151e | ||
| CHEMBL483160 | 184191 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1CC2 | 10.1021/jm900151e | ||
| 57412301 | 76106 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 218 | 3 | 2 | 2 | 1.8 | O=C(O)c1n[nH]c2c1C[C@H]1[C@@H](CC3CC3)[C@@H]21 | 10.1021/jm2010964 | ||
| CHEMBL2057602 | 76106 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 218 | 3 | 2 | 2 | 1.8 | O=C(O)c1n[nH]c2c1C[C@H]1[C@@H](CC3CC3)[C@@H]21 | 10.1021/jm2010964 | ||
| 136000580 | 61449 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770356 | 61449 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | ||
| 1591 | 131 | 63 | None | 33 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.07.101 | ||
| 6485181 | 131 | 63 | None | 33 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.07.101 | ||
| CHEMBL428730 | 131 | 63 | None | 33 | 2 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1016/j.bmcl.2007.07.101 | ||
| 57412303 | 76110 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 224 | 3 | 2 | 3 | 1.4 | CSC[C@@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@@H]12 | 10.1021/jm2010964 | ||
| CHEMBL2057606 | 76110 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 224 | 3 | 2 | 3 | 1.4 | CSC[C@@H]1[C@H]2c3[nH]nc(C(=O)O)c3C[C@@H]12 | 10.1021/jm2010964 | ||
| 11617480 | 88681 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 362 | 6 | 3 | 4 | 3.7 | O=C(CCc1ccc(-c2ccc(O)cn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL235952 | 88681 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 362 | 6 | 3 | 4 | 3.7 | O=C(CCc1ccc(-c2ccc(O)cn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 776416 | 18938 | 108 | None | -5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| CHEMBL128604 | 18938 | 108 | None | -5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | ||
| 57398905 | 69927 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3cccc(OC)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939022 | 69927 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 328 | 5 | 1 | 6 | 2.0 | CCc1cc(=O)oc2nc(OCc3cccc(OC)c3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 776416 | 18938 | 108 | None | -5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL128604 | 18938 | 108 | None | -5 | 2 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2007.06.028 | ||
| 44441304 | 93418 | 20 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 156 | 3 | 2 | 3 | 0.3 | COCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL245858 | 93418 | 20 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 156 | 3 | 2 | 3 | 0.3 | COCc1cc(C(=O)O)[nH]n1 | 10.1016/j.bmcl.2007.06.028 | ||
| 44441321 | 93832 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 182 | 2 | 2 | 3 | 1.1 | CCC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247723 | 93832 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 182 | 2 | 2 | 3 | 1.1 | CCC1OCc2c1n[nH]c2C(=O)O | 10.1016/j.bmcl.2007.06.028 | ||
| 136088962 | 61401 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770176 | 61401 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 11041813 | 93751 | 22 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 202 | 3 | 2 | 2 | 1.7 | O=C(O)c1cc(Cc2ccccc2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| CHEMBL247317 | 93751 | 22 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 202 | 3 | 2 | 2 | 1.7 | O=C(O)c1cc(Cc2ccccc2)n[nH]1 | 10.1016/j.bmcl.2007.06.028 | ||
| 137648386 | 157772 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 347 | 4 | 3 | 3 | 3.2 | O=C(CCC#Cc1ccc(O)cc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| CHEMBL4082765 | 157772 | 0 | None | - | 1 | Human | 8.1 | pEC50 | = | 8.1 | Functional | ChEMBL | 347 | 4 | 3 | 3 | 3.2 | O=C(CCC#Cc1ccc(O)cc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | ||
| 24954201 | 69953 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 314 | 5 | 1 | 5 | 2.0 | CCC#CCOc1nc2oc(=O)cc(CCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939048 | 69953 | 0 | None | - | 1 | Human | 7.1 | pEC50 | = | 7.1 | Functional | ChEMBL | 314 | 5 | 1 | 5 | 2.0 | CCC#CCOc1nc2oc(=O)cc(CCC3CC3)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 90645402 | 112482 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 335 | 2 | 3 | 3 | 2.9 | O=C(C#Cc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| CHEMBL3298702 | 112482 | 0 | None | - | 1 | Human | 6.1 | pEC50 | = | 6.1 | Functional | ChEMBL | 335 | 2 | 3 | 3 | 2.9 | O=C(C#Cc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2014.05.011 | ||
| 16048923 | 94656 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL252506 | 94656 | 0 | None | - | 1 | Human | 5.1 | pEC50 | = | 5.1 | Functional | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | ||
| 15981408 | 94346 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | ||
| CHEMBL250690 | 94346 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | ||
| 57391932 | 69940 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 246 | 3 | 1 | 5 | 0.5 | C#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939035 | 69940 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 246 | 3 | 1 | 5 | 0.5 | C#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 44250176 | 1131 | 0 | None | -2951 | 2 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 319 | 6 | 2 | 5 | 3.4 | OC(=O)c1n[nH]c(c1)N(Cc1cscc1)Cc1cscc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 5800 | 1131 | 0 | None | -2951 | 2 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 319 | 6 | 2 | 5 | 3.4 | OC(=O)c1n[nH]c(c1)N(Cc1cscc1)Cc1cscc1 | 10.1016/j.bmcl.2009.05.108 | ||
| CHEMBL564300 | 1131 | 0 | None | -2951 | 2 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 319 | 6 | 2 | 5 | 3.4 | OC(=O)c1n[nH]c(c1)N(Cc1cscc1)Cc1cscc1 | 10.1016/j.bmcl.2009.05.108 | ||
| 24811547 | 7376 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 415 | 6 | 3 | 3 | 4.9 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1086355 | 7376 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 415 | 6 | 3 | 3 | 4.9 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 24741307 | 88735 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1021/jm700942d | ||
| CHEMBL236163 | 88735 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1021/jm700942d | ||
| 57400596 | 69936 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 300 | 4 | 1 | 7 | 0.8 | CCc1cc(=O)oc2nc(OCc3ccnnc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939031 | 69936 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 300 | 4 | 1 | 7 | 0.8 | CCc1cc(=O)oc2nc(OCc3ccnnc3)[nH]c(=O)c12 | 10.1016/j.bmcl.2011.12.041 | ||
| 11610363 | 89490 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1ncc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL237247 | 89490 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1ncc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 44579645 | 187068 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 444 | 8 | 1 | 6 | 4.6 | COc1cccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)c1 | 10.1016/j.bmcl.2008.08.039 | ||
| CHEMBL491227 | 187068 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 444 | 8 | 1 | 6 | 4.6 | COc1cccc(OCCNC(=O)c2cnc3c(-c4ccc(C(C)C)cc4)cnn3c2C)c1 | 10.1016/j.bmcl.2008.08.039 | ||
| 135627640 | 61397 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 417 | 6 | 4 | 6 | 3.4 | NC(Cc1cnc(-c2ccc(O)cc2Cl)s1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| CHEMBL1770172 | 61397 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 417 | 6 | 4 | 6 | 3.4 | NC(Cc1cnc(-c2ccc(O)cc2Cl)s1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | ||
| 15605292 | 75238 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 266 | 3 | 2 | 6 | -0.7 | CCOC(=O)Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036819 | 75238 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 266 | 3 | 2 | 6 | -0.7 | CCOC(=O)Cc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 11992789 | 196598 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 343 | 6 | 2 | 3 | 3.6 | O=C(O)c1cc(N(Cc2cccc(F)c2)Cc2cccc(F)c2)[nH]n1 | 10.1016/j.bmcl.2009.05.108 | ||
| CHEMBL564064 | 196598 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 343 | 6 | 2 | 3 | 3.6 | O=C(O)c1cc(N(Cc2cccc(F)c2)Cc2cccc(F)c2)[nH]n1 | 10.1016/j.bmcl.2009.05.108 | ||
| 46890328 | 6681 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 484 | 6 | 3 | 4 | 5.3 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(C(F)(F)F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1083451 | 6681 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 484 | 6 | 3 | 4 | 5.3 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(C(F)(F)F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 44579742 | 187044 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 347 | 6 | 2 | 3 | 3.9 | O=Cc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | ||
| CHEMBL491003 | 187044 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 347 | 6 | 2 | 3 | 3.9 | O=Cc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | ||
| 136375455 | 177554 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 385 | 7 | 3 | 8 | 2.5 | CC(C)n1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| CHEMBL4640349 | 177554 | 0 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | ChEMBL | 385 | 7 | 3 | 8 | 2.5 | CC(C)n1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | ||
| 57395377 | 69942 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 274 | 3 | 1 | 5 | 1.2 | CCC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| CHEMBL1939037 | 69942 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 274 | 3 | 1 | 5 | 1.2 | CCC#CCOc1nc2oc(=O)cc(CC)c2c(=O)[nH]1 | 10.1016/j.bmcl.2011.12.041 | ||
| 11566404 | 145671 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 346 | 6 | 2 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| CHEMBL391603 | 145671 | 0 | None | - | 1 | Human | 6.0 | pEC50 | = | 6.0 | Functional | ChEMBL | 346 | 6 | 2 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | ||
| 136086824 | 6843 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 453 | 7 | 3 | 8 | 2.7 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| CHEMBL1084031 | 6843 | 0 | None | - | 1 | Human | 7.0 | pEC50 | = | 7.0 | Functional | ChEMBL | 453 | 7 | 3 | 8 | 2.7 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/ml200243g | ||
| 59304624 | 75234 | 2 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 222 | 2 | 2 | 4 | 0.1 | CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| CHEMBL2036812 | 75234 | 2 | None | - | 1 | Human | 7.0 | pEC50 | = | 7 | Functional | ChEMBL | 222 | 2 | 2 | 4 | 0.1 | CCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1021/ml200243g | ||
| 13557 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1074/jbc.m701866200 | ||
| 853085 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1074/jbc.m701866200 | ||
| CHEMBL393428 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | ChEMBL | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 10.1074/jbc.m701866200 | ||
| 11550911 | 95188 | 1 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 280 | 3 | 2 | 2 | 2.5 | O=C(O)c1cc(Cc2cccc(Br)c2)[nH]n1 | 10.1074/jbc.m701866200 | ||
| CHEMBL255877 | 95188 | 1 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Functional | ChEMBL | 280 | 3 | 2 | 2 | 2.5 | O=C(O)c1cc(Cc2cccc(Br)c2)[nH]n1 | 10.1074/jbc.m701866200 | ||
| 11557600 | 167382 | 1 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 1.8 | O=C(O)c1cc(Cc2cccc(F)c2)[nH]n1 | 10.1074/jbc.m701866200 | ||
| CHEMBL429495 | 167382 | 1 | None | - | 1 | Human | 5.7 | pIC50 | = | 5.7 | Functional | ChEMBL | 220 | 3 | 2 | 2 | 1.8 | O=C(O)c1cc(Cc2cccc(F)c2)[nH]n1 | 10.1074/jbc.m701866200 | ||
| 776421 | 89928 | 108 | None | 30 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1074/jbc.m701866200 | ||
| CHEMBL238002 | 89928 | 108 | None | 30 | 2 | Human | 5.6 | pIC50 | = | 5.6 | Functional | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1074/jbc.m701866200 | ||
| 11776293 | 149257 | 8 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1074/jbc.m701866200 | ||
| CHEMBL394441 | 149257 | 8 | None | - | 1 | Human | 5.4 | pIC50 | = | 5.4 | Functional | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1074/jbc.m701866200 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Functional | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1021/jm800896z | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 4.2 | pIC50 | = | 4.2 | Functional | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | ||
| 108 | 111 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | None | ||
| 1590 | 111 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | None | ||
| 3505 | 111 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | None | ||
| CHEMBL1741437 | 111 | 0 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | None | ||
| 1596 | 260 | 96 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | None | ||
| 5310993 | 260 | 96 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | None | ||
| 76 | 260 | 96 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | None | ||
| CHEMBL345714 | 260 | 96 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | None | ||
| DB09055 | 260 | 96 | None | - | 1 | Human | 8.3 | pEC50 | = | 8.3 | Functional | Drug Central | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | None | ||
| 13558 | 1041 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | Guide to Pharmacology | 242 | 3 | 2 | 4 | 0.9 | C(CCC)N1C(NC(C=2NC(=NC12)Cl)=O)=O | None | ||
| 59299562 | 1041 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | Guide to Pharmacology | 242 | 3 | 2 | 4 | 0.9 | C(CCC)N1C(NC(C=2NC(=NC12)Cl)=O)=O | None | ||
| CHEMBL3732182 | 1041 | 0 | None | - | 1 | Human | 7.2 | pEC50 | = | 7.2 | Functional | Guide to Pharmacology | 242 | 3 | 2 | 4 | 0.9 | C(CCC)N1C(NC(C=2NC(=NC12)Cl)=O)=O | None | ||
| 13559 | 1135 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 460 | 9 | 1 | 9 | 2.1 | C(CCC)N1C(N(C(C=2NC(=NC12)Cl)=O)CCCN3N=C(N=N3)CC4=CC=C(C=C4)F)=O | None | ||
| 59395852 | 1135 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 460 | 9 | 1 | 9 | 2.1 | C(CCC)N1C(N(C(C=2NC(=NC12)Cl)=O)CCCN3N=C(N=N3)CC4=CC=C(C=C4)F)=O | None | ||
| 1059 | 750 | 81 | None | -67 | 3 | Human | 2.8 | pEC50 | = | 2.8 | Functional | Guide to Pharmacology | 88 | 2 | 1 | 1 | 0.9 | CCCC(=O)O | None | ||
| 264 | 750 | 81 | None | -67 | 3 | Human | 2.8 | pEC50 | = | 2.8 | Functional | Guide to Pharmacology | 88 | 2 | 1 | 1 | 0.9 | CCCC(=O)O | None | ||
| CHEMBL14227 | 750 | 81 | None | -67 | 3 | Human | 2.8 | pEC50 | = | 2.8 | Functional | Guide to Pharmacology | 88 | 2 | 1 | 1 | 0.9 | CCCC(=O)O | None | ||
| DB03568 | 750 | 81 | None | -67 | 3 | Human | 2.8 | pEC50 | = | 2.8 | Functional | Guide to Pharmacology | 88 | 2 | 1 | 1 | 0.9 | CCCC(=O)O | None | ||
| 1593 | 609 | 0 | None | -2 | 2 | Human | 3.1 | pEC50 | = | 3.1 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| 92135 | 609 | 0 | None | -2 | 2 | Human | 3.1 | pEC50 | = | 3.1 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| CHEMBL1162484 | 609 | 0 | None | -2 | 2 | Human | 3.1 | pEC50 | = | 3.1 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| 5787 | 3005 | 119 | None | - | 1 | Human | 3.5 | pEC50 | = | 3.5 | Functional | Guide to Pharmacology | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 19136666 | ||
| 637542 | 3005 | 119 | None | - | 1 | Human | 3.5 | pEC50 | = | 3.5 | Functional | Guide to Pharmacology | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 19136666 | ||
| CHEMBL66879 | 3005 | 119 | None | - | 1 | Human | 3.5 | pEC50 | = | 3.5 | Functional | Guide to Pharmacology | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 19136666 | ||
| DB04066 | 3005 | 119 | None | - | 1 | Human | 3.5 | pEC50 | = | 3.5 | Functional | Guide to Pharmacology | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 19136666 | ||
| 3203 | 939 | 111 | None | - | 1 | Human | 3.6 | pEC50 | = | 3.6 | Functional | Guide to Pharmacology | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 19136666 | ||
| 444539 | 939 | 111 | None | - | 1 | Human | 3.6 | pEC50 | = | 3.6 | Functional | Guide to Pharmacology | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 19136666 | ||
| CHEMBL27246 | 939 | 111 | None | - | 1 | Human | 3.6 | pEC50 | = | 3.6 | Functional | Guide to Pharmacology | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 19136666 | ||
| 5369209 | 2591 | 81 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 18722346 | ||
| 5786 | 2591 | 81 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 18722346 | ||
| CHEMBL589586 | 2591 | 81 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 18722346 | ||
| DB14219 | 2591 | 81 | None | - | 1 | Human | 5.0 | pEC50 | = | 5.0 | Functional | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 18722346 | ||
| 1596 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12522134 | ||
| 1596 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12646212 | ||
| 5310993 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12522134 | ||
| 5310993 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12646212 | ||
| 76 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12522134 | ||
| 76 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12646212 | ||
| CHEMBL345714 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12522134 | ||
| CHEMBL345714 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12646212 | ||
| DB09055 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12522134 | ||
| DB09055 | 260 | 96 | None | - | 1 | Human | 5.4 | pEC50 | = | 5.4 | Functional | Guide to Pharmacology | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 12646212 | ||
| 5794 | 1096 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | Guide to Pharmacology | 446 | 6 | 1 | 5 | 4.3 | ClC1CCC(CC1Cl)c1cnn2c1ncc(c2C)C(=O)NCCOc1ccccc1 | 22420767 | ||
| 73755156 | 1096 | 0 | None | - | 1 | Human | 5.6 | pEC50 | = | 5.6 | Functional | Guide to Pharmacology | 446 | 6 | 1 | 5 | 4.3 | ClC1CCC(CC1Cl)c1cnn2c1ncc(c2C)C(=O)NCCOc1ccccc1 | 22420767 | ||
| 11159621 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | Guide to Pharmacology | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 18665582 | ||
| 5784 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | Guide to Pharmacology | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 18665582 | ||
| CHEMBL456145 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | Guide to Pharmacology | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 18665582 | ||
| DB05939 | 2548 | 46 | None | -1 | 3 | Human | 5.8 | pEC50 | = | 5.8 | Functional | Guide to Pharmacology | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 18665582 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| 117629482 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| 1588 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| 1594 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| 2835 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| 938 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| CHEMBL573 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | ||
| DB00627 | 2823 | 140 | None | -4 | 4 | Human | 6.6 | pEC50 | = | 6.6 | Functional | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | ||
| 25101223 | 1152 | 7 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | Guide to Pharmacology | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 18752940 | ||
| 5795 | 1152 | 7 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | Guide to Pharmacology | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 18752940 | ||
| CHEMBL490599 | 1152 | 7 | None | - | 1 | Human | 6.8 | pEC50 | = | 6.8 | Functional | Guide to Pharmacology | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 18752940 | ||
| 11672811 | 1001 | 5 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 20363624 | ||
| 5790 | 1001 | 5 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 20363624 | ||
| CHEMBL1169573 | 1001 | 5 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 188 | 1 | 2 | 4 | 0.2 | n1nnc([nH]1)c1n[nH]c2c1CC1C2C1 | 20363624 | ||
| 13359 | 1099 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 442 | 9 | 3 | 7 | 4.8 | CNCCNCC1=CC=CC(=C1)C2=NC(C3=C(C)ON=C3C)=C(C)C(NC4=CC=CC=C4)=N2 | None | ||
| 146188223 | 1099 | 0 | None | - | 1 | Human | 7.4 | pEC50 | = | 7.4 | Functional | Guide to Pharmacology | 442 | 9 | 3 | 7 | 4.8 | CNCCNCC1=CC=CC(=C1)C2=NC(C3=C(C)ON=C3C)=C(C)C(NC4=CC=CC=C4)=N2 | None | ||
| 46215799 | 1880 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | Guide to Pharmacology | 256 | 4 | 2 | 4 | 1.3 | CCCCCn1c(=O)[nH]c(=O)c2c1nc([nH]2)Cl | 25773497 | ||
| 8470 | 1880 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | Guide to Pharmacology | 256 | 4 | 2 | 4 | 1.3 | CCCCCn1c(=O)[nH]c(=O)c2c1nc([nH]2)Cl | 25773497 | ||
| CHEMBL3730241 | 1880 | 0 | None | - | 1 | Human | 7.5 | pEC50 | = | 7.5 | Functional | Guide to Pharmacology | 256 | 4 | 2 | 4 | 1.3 | CCCCCn1c(=O)[nH]c(=O)c2c1nc([nH]2)Cl | 25773497 | ||
| 11607970 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | Guide to Pharmacology | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 22435740 | ||
| 5785 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | Guide to Pharmacology | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 22435740 | ||
| CHEMBL2059221 | 2552 | 10 | None | - | 1 | Human | 7.6 | pEC50 | = | 7.6 | Functional | Guide to Pharmacology | 164 | 1 | 2 | 2 | 0.8 | OC(=O)c1n[nH]c2c1CC1C2C1 | 22435740 | ||
| 135416394 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | ||
| 5788 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | ||
| 73755154 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | ||
| CHEMBL1086657 | 2560 | 52 | None | 15 | 3 | Human | 7.8 | pEC50 | = | 7.8 | Functional | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | ||
| 56950369 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | Guide to Pharmacology | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 24900372 | ||
| 8469 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | Guide to Pharmacology | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 24900372 | ||
| CHEMBL2036958 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | Guide to Pharmacology | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 24900372 | ||
| DB12433 | 3559 | 13 | None | 3 | 4 | Human | 8.7 | pEC50 | = | 8.7 | Functional | Guide to Pharmacology | 276 | 4 | 2 | 4 | 1.3 | O=c1cc(CCCC2(C)CC2)c2c(o1)[nH]c(=O)[nH]c2=O | 24900372 | ||
| 1593 | 609 | 0 | None | 2 | 2 | Mouse | 3.5 | pEC50 | None | 3.5 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| 92135 | 609 | 0 | None | 2 | 2 | Mouse | 3.5 | pEC50 | None | 3.5 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| CHEMBL1162484 | 609 | 0 | None | 2 | 2 | Mouse | 3.5 | pEC50 | None | 3.5 | Functional | Guide to Pharmacology | 104 | 2 | 2 | 2 | -0.2 | C[C@H](CC(=O)O)O | 15929991 | ||
| 1592 | 144 | 131 | None | - | 1 | Human | 5.1 | pEC50 | None | 5.1 | Functional | Guide to Pharmacology | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 12522134 | ||
| 256208 | 144 | 131 | None | - | 1 | Human | 5.1 | pEC50 | None | 5.1 | Functional | Guide to Pharmacology | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 12522134 | ||
| CHEMBL247132 | 144 | 131 | None | - | 1 | Human | 5.1 | pEC50 | None | 5.1 | Functional | Guide to Pharmacology | 137 | 1 | 1 | 2 | 1.1 | Cc1cc(cnc1)C(=O)O | 12522134 | ||
| 108 | 111 | 0 | None | - | 1 | Human | 5.3 | pEC50 | None | 5.3 | Functional | Guide to Pharmacology | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | 12522134 | ||
| 1590 | 111 | 0 | None | - | 1 | Human | 5.3 | pEC50 | None | 5.3 | Functional | Guide to Pharmacology | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | 12522134 | ||
| 3505 | 111 | 0 | None | - | 1 | Human | 5.3 | pEC50 | None | 5.3 | Functional | Guide to Pharmacology | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | 12522134 | ||
| CHEMBL1741437 | 111 | 0 | None | - | 1 | Human | 5.3 | pEC50 | None | 5.3 | Functional | Guide to Pharmacology | 137 | 2 | 1 | 2 | 0.7 | OC(=O)Cc1cccnc1 | 12522134 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 12522134 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 15929991 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 16389067 | ||
| 1595 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 17358052 | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 12522134 | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 15929991 | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 16389067 | ||
| 51576 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 17358052 | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 12522134 | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 15929991 | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 16389067 | ||
| CHEMBL278488 | 259 | 49 | None | 4 | 2 | Human | 5.8 | pEC50 | None | 5.8 | Functional | Guide to Pharmacology | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 17358052 | ||
| 11483496 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 15929991 | ||
| 11483496 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 17358052 | ||
| 1589 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 15929991 | ||
| 1589 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 17358052 | ||
| CHEMBL375493 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 15929991 | ||
| CHEMBL375493 | 126 | 0 | None | 14 | 2 | Human | 7.3 | pEC50 | None | 7.3 | Functional | Guide to Pharmacology | 302 | 2 | 1 | 4 | 2.3 | Brc1scc(c1)C1(C)OC(=CC1=O)C(=O)O | 17358052 | ||
| 53232 | 188625 | 95 | None | -1 | 10 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 404 | 6 | 1 | 5 | 4.2 | CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21 | None | ||
| CHEMBL503 | 188625 | 95 | None | -1 | 10 | Human | 8.1 | pIC50 | = | 8.1 | Functional | Drug Central | 404 | 6 | 1 | 5 | 4.2 | CC[C@H](C)C(=O)O[C@H]1C[C@@H](C)C=C2C=C[C@H](C)[C@H](CC[C@@H]3C[C@@H](O)CC(=O)O3)[C@H]21 | None | ||
| 13557 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 17452318 | ||
| 853085 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 17452318 | ||
| CHEMBL393428 | 1106 | 111 | None | - | 1 | Human | 5.9 | pIC50 | = | 5.9 | Functional | Guide to Pharmacology | 127 | 1 | 1 | 3 | 0.7 | CC1=NOC(=C1)C(=O)O | 17452318 | ||
| 12003694 | 1144 | 0 | None | 1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 20615702 | ||
| 5793 | 1144 | 0 | None | 1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 20615702 | ||
| CHEMBL1208986 | 1144 | 0 | None | 1 | 2 | Human | 6.4 | pIC50 | = | 6.4 | Functional | Guide to Pharmacology | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 20615702 | ||
| 135401973 | 1022 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 18029181 | ||
| 5792 | 1022 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 18029181 | ||
| CHEMBL398496 | 1022 | 0 | None | - | 1 | Human | 6.9 | pIC50 | = | 6.9 | Functional | Guide to Pharmacology | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 18029181 | ||
| 11494579 | 1058 | 0 | None | 123 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 19309152 | ||
| 5791 | 1058 | 0 | None | 123 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 19309152 | ||
| CHEMBL482768 | 1058 | 0 | None | 123 | 2 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 19309152 | ||
| 53238781 | 1027 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 21185185 | ||
| 5789 | 1027 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 21185185 | ||
| CHEMBL1770358 | 1027 | 0 | None | - | 1 | Human | 7.9 | pIC50 | = | 7.9 | Functional | Guide to Pharmacology | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 21185185 | ||
| Ligands (move mouse cursor over ligand name to see structure) | Receptor | Assay information | Chemical information | |||||||||||||||||||
|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|---|
| Sel. page | Similar- ity |
Common name |
GPCRdb ID |
#Vendors |
Reference ligand |
Fold selectivity |
# Tested GPCRs |
Species |
p-value (-log) |
Activity Type |
Activity Relation |
Activity Value |
Assay Type |
Assay Description |
Source |
Mol weight |
Rot Bonds |
H don |
H acc |
LogP |
Smiles |
DOI |
| 1596 | 260 | 96 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 5310993 | 260 | 96 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 76 | 260 | 96 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| CHEMBL345714 | 260 | 96 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| DB09055 | 260 | 96 | None | - | 0 | Human | 5.4 | pAC50 | = | 5.4 | Binding | ChEMBL | 154 | 1 | 1 | 3 | -0.3 | [O-][n+]1cc(ncc1C)C(=O)O | 10.1038/s41467-023-40064-9 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.0 | pEC50 | = | 6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 11516424 | 7315 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 379 | 6 | 3 | 5 | 3.4 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086104 | 7315 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 379 | 6 | 3 | 5 | 3.4 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 11625092 | 6684 | 0 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1083473 | 6684 | 0 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 156017170 | 177648 | 0 | None | - | 0 | Human | 4.9 | pEC50 | = | 4.9 | Binding | ChEMBL | 417 | 5 | 1 | 6 | 4.4 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccccc3s2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4641449 | 177648 | 0 | None | - | 0 | Human | 4.9 | pEC50 | = | 4.9 | Binding | ChEMBL | 417 | 5 | 1 | 6 | 4.4 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccccc3s2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 57422810 | 177661 | 4 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 602 | 7 | 2 | 10 | 4.4 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3ccc(S(=O)(=O)C4CCN(C)CC4)cc3s2)cc1-n1cccn1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4641579 | 177661 | 4 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 602 | 7 | 2 | 10 | 4.4 | CCOc1cc(Cl)c(C(=O)NC(=O)Nc2nc3ccc(S(=O)(=O)C4CCN(C)CC4)cc3s2)cc1-n1cccn1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890275 | 6530 | 0 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 412 | 8 | 3 | 6 | 3.2 | CCCC1CCC(C(=O)O)=C(NC(=O)C(C)Cc2ccn(-c3ccc(O)cn3)n2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1082823 | 6530 | 0 | None | - | 0 | Human | 6.9 | pEC50 | = | 6.9 | Binding | ChEMBL | 412 | 8 | 3 | 6 | 3.2 | CCCC1CCC(C(=O)O)=C(NC(=O)C(C)Cc2ccn(-c3ccc(O)cn3)n2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 24741310 | 89622 | 0 | None | - | 0 | Human | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL237543 | 89622 | 0 | None | - | 0 | Human | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.8 | pEC50 | = | 7.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/acs.jmedchem.8b00435 | |||
| 156021885 | 178215 | 0 | None | - | 0 | Human | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | 635 | 10 | 1 | 10 | 4.2 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1CCO[C@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4649741 | 178215 | 0 | None | - | 0 | Human | 5.9 | pEC50 | = | 5.9 | Binding | ChEMBL | 635 | 10 | 1 | 10 | 4.2 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1CCO[C@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| 1595 | 259 | 49 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmc.2015.02.018 | |||
| 51576 | 259 | 49 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL278488 | 259 | 49 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 218 | 2 | 1 | 3 | 1.5 | OC(=O)C1=CC(=O)C(O1)(C)c1ccccc1 | 10.1016/j.bmc.2015.02.018 | |||
| 156018500 | 177924 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 629 | 7 | 1 | 10 | 4.5 | CCOc1cc(Cl)c(-c2ncc(-c3nc4ccc(S(=O)(=O)C5CCN(C)CC5)cc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4645314 | 177924 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 629 | 7 | 1 | 10 | 4.5 | CCOc1cc(Cl)c(-c2ncc(-c3nc4ccc(S(=O)(=O)C5CCN(C)CC5)cc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 156019324 | 177974 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 530 | 7 | 1 | 8 | 4.9 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(OC4CCN(C)CC4)cc3s2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4646005 | 177974 | 0 | None | - | 0 | Human | 5.8 | pEC50 | = | 5.8 | Binding | ChEMBL | 530 | 7 | 1 | 8 | 4.9 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(OC4CCN(C)CC4)cc3s2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890274 | 6906 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.4 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC[C@@H](C)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084332 | 6906 | 0 | None | - | 0 | Human | 6.8 | pEC50 | = | 6.8 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.4 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC[C@@H](C)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890273 | 6849 | 0 | None | - | 0 | Human | 4.8 | pEC50 | = | 4.8 | Binding | ChEMBL | 358 | 6 | 3 | 6 | 1.7 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)N[C@@H]1CCCC[C@@H]1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084060 | 6849 | 0 | None | - | 0 | Human | 4.8 | pEC50 | = | 4.8 | Binding | ChEMBL | 358 | 6 | 3 | 6 | 1.7 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)N[C@@H]1CCCC[C@@H]1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 156011618 | 177398 | 0 | None | - | 0 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 544 | 7 | 1 | 8 | 3.6 | CCOc1cc(Cl)c(-c2ccc(-c3nc4c(s3)CN(C(=O)COC)CC4)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4638263 | 177398 | 0 | None | - | 0 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 544 | 7 | 1 | 8 | 3.6 | CCOc1cc(Cl)c(-c2ccc(-c3nc4c(s3)CN(C(=O)COC)CC4)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 15986936 | 7101 | 0 | None | - | 0 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1cnn(-c2ccc(O)cn2)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085150 | 7101 | 0 | None | - | 0 | Human | 6.7 | pEC50 | = | 6.7 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1cnn(-c2ccc(O)cn2)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 11197 | 1066 | 0 | None | - | 0 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 572 | 7 | 2 | 9 | 3.9 | CCOc1cc(Cl)c(cc1N1CCOCC1)C(=O)NC(=O)Nc1nc2c(s1)cc(cc2)CN1CCN(CC1)C | 10.1016/j.bmcl.2020.126953 | |||
| 154699458 | 1066 | 0 | None | - | 0 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 572 | 7 | 2 | 9 | 3.9 | CCOc1cc(Cl)c(cc1N1CCOCC1)C(=O)NC(=O)Nc1nc2c(s1)cc(cc2)CN1CCN(CC1)C | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4632411 | 1066 | 0 | None | - | 0 | Human | 5.7 | pEC50 | = | 5.7 | Binding | ChEMBL | 572 | 7 | 2 | 9 | 3.9 | CCOc1cc(Cl)c(cc1N1CCOCC1)C(=O)NC(=O)Nc1nc2c(s1)cc(cc2)CN1CCN(CC1)C | 10.1016/j.bmcl.2020.126953 | |||
| 46890276 | 6531 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 464 | 7 | 3 | 6 | 3.7 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1082824 | 6531 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 464 | 7 | 3 | 6 | 3.7 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890240 | 7103 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085156 | 7103 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890237 | 7099 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | Cc1c(CCC(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085148 | 7099 | 0 | None | - | 0 | Human | 6.6 | pEC50 | = | 6.6 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | Cc1c(CCC(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890199 | 7158 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 380 | 6 | 3 | 6 | 2.8 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085401 | 7158 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 380 | 6 | 3 | 6 | 2.8 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 156016073 | 177655 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 649 | 10 | 1 | 10 | 4.6 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1C[C@H](C)O[C@@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4641503 | 177655 | 0 | None | - | 0 | Human | 5.5 | pEC50 | = | 5.5 | Binding | ChEMBL | 649 | 10 | 1 | 10 | 4.6 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1C[C@H](C)O[C@@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890165 | 7314 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 351 | 6 | 3 | 5 | 2.8 | O=C(CCc1cnn(-c2ccc(O)cc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086103 | 7314 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 351 | 6 | 3 | 5 | 2.8 | O=C(CCc1cnn(-c2ccc(O)cc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 15986929 | 7159 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 383 | 6 | 3 | 5 | 3.1 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085402 | 7159 | 0 | None | - | 0 | Human | 6.5 | pEC50 | = | 6.5 | Binding | ChEMBL | 383 | 6 | 3 | 5 | 3.1 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 156016110 | 177698 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 628 | 7 | 1 | 9 | 5.1 | CCOc1cc(Cl)c(-c2ccc(-c3nc4ccc(S(=O)(=O)C5CCN(C)CC5)cc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4642043 | 177698 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 628 | 7 | 1 | 9 | 5.1 | CCOc1cc(Cl)c(-c2ccc(-c3nc4ccc(S(=O)(=O)C5CCN(C)CC5)cc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890272 | 6847 | 0 | None | - | 0 | Human | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084059 | 6847 | 0 | None | - | 0 | Human | 6.4 | pEC50 | = | 6.4 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890164 | 7422 | 0 | None | - | 0 | Human | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086568 | 7422 | 0 | None | - | 0 | Human | 5.4 | pEC50 | = | 5.4 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 11560300 | 88539 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL235256 | 88539 | 0 | None | - | 0 | Human | 7.4 | pEC50 | = | 7.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 53322689 | 58060 | 1 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL1672755 | 58060 | 1 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 224 | 1 | 2 | 5 | 0.7 | CCc1cc(=O)oc2nc(S)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| 15605571 | 75235 | 2 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL2036813 | 75235 | 2 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 236 | 3 | 2 | 4 | 0.5 | CCCCc1cc(=O)oc2[nH]c(=O)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL5270112 | 193620 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 252 | 3 | 2 | 4 | 1.9 | CCCCc1cc(=O)oc2[nH]c(=S)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL5275861 | 193872 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 286 | 4 | 2 | 4 | 2.1 | O=c1cc(CCCCCl)c2c(=O)[nH]c(=S)[nH]c2o1 | 10.1039/d2md00076h | |||
| CHEMBL5277000 | 193921 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 238 | 2 | 2 | 4 | 1.5 | CCCc1cc(=O)oc2[nH]c(=S)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL5281556 | 194116 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 210 | 0 | 2 | 4 | 0.8 | Cc1cc(=O)oc2[nH]c(=S)[nH]c(=O)c12 | 10.1039/d2md00076h | |||
| CHEMBL5284951 | 194273 | 0 | None | - | 0 | Human | 7.3 | pEC50 | = | 7.3 | Binding | ChEMBL | 270 | 4 | 2 | 4 | 0.7 | O=c1[nH]c(=O)c2c(CCCCCl)cc(=O)oc2[nH]1 | 10.1039/d2md00076h | |||
| 46890239 | 6934 | 0 | None | - | 0 | Human | 6.3 | pEC50 | = | 6.3 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1cnn(-c2ccc(O)cn2)c1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084448 | 6934 | 0 | None | - | 0 | Human | 6.3 | pEC50 | = | 6.3 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1cnn(-c2ccc(O)cn2)c1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1074/jbc.m701866200 | |||
| 156021336 | 178167 | 0 | None | - | 0 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 467 | 5 | 1 | 6 | 5.2 | CCOc1cc(Cl)c(-c2ccc(-c3nc4ccccc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4649089 | 178167 | 0 | None | - | 0 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 467 | 5 | 1 | 6 | 5.2 | CCOc1cc(Cl)c(-c2ccc(-c3nc4ccccc4s3)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890301 | 7199 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085616 | 7199 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 156012428 | 177310 | 0 | None | - | 0 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 649 | 10 | 1 | 10 | 4.6 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1C[C@H](C)O[C@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4636832 | 177310 | 0 | None | - | 0 | Human | 6.2 | pEC50 | = | 6.2 | Binding | ChEMBL | 649 | 10 | 1 | 10 | 4.6 | CCOc1cc(Cl)c(C(=O)Nc2nc3ccc(S(=O)(=O)CCCN4CCN(C)CC4)cc3s2)cc1N1C[C@H](C)O[C@H](C)C1 | 10.1016/j.bmcl.2020.126953 | |||
| 46890300 | 7415 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2F)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086541 | 7415 | 0 | None | - | 0 | Human | 7.2 | pEC50 | = | 7.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2F)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890198 | 7317 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.6 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086108 | 7317 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.6 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890238 | 7100 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.5 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085149 | 7100 | 0 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.5 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 9822 | 145638 | 133 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1074/jbc.m701866200 | |||
| CHEMBL391574 | 145638 | 133 | None | - | 0 | Human | 6.1 | pEC50 | = | 6.1 | Binding | ChEMBL | 126 | 1 | 2 | 2 | 0.4 | Cc1cc(C(=O)O)n[nH]1 | 10.1074/jbc.m701866200 | |||
| 156014693 | 177192 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 530 | 6 | 2 | 8 | 2.9 | CCOc1cc(Cl)c(-c2ccc(-c3nc4c(s3)CN(C(=O)CO)CC4)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| CHEMBL4635089 | 177192 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 530 | 6 | 2 | 8 | 2.9 | CCOc1cc(Cl)c(-c2ccc(-c3nc4c(s3)CN(C(=O)CO)CC4)c(=O)[nH]2)cc1N1CCOCC1 | 10.1016/j.bmcl.2020.126953 | |||
| 24741307 | 88735 | 0 | None | - | 0 | Human | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL236163 | 88735 | 0 | None | - | 0 | Human | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890197 | 7259 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.5 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085875 | 7259 | 0 | None | - | 0 | Human | 6.0 | pEC50 | = | 6.0 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.5 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 46890302 | 7252 | 0 | None | - | 0 | Human | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 500 | 7 | 3 | 6 | 4.0 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cc(F)c(F)c(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085842 | 7252 | 0 | None | - | 0 | Human | 7.0 | pEC50 | = | 7.0 | Binding | ChEMBL | 500 | 7 | 3 | 6 | 4.0 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cc(F)c(F)c(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890163 | 7421 | 0 | None | - | 0 | Human | 5.0 | pEC50 | = | 5.0 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1ccn(-c2ccccc2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086567 | 7421 | 0 | None | - | 0 | Human | 5.0 | pEC50 | = | 5.0 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1ccn(-c2ccccc2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 135453098 | 88734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL236162 | 88734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 42625475 | 184209 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 414 | 5 | 3 | 5 | 4.3 | O=C(CCc1noc2c1ccc1c(Cl)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL483336 | 184209 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 414 | 5 | 3 | 5 | 4.3 | O=C(CCc1noc2c1ccc1c(Cl)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 42625476 | 184210 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 379 | 5 | 3 | 5 | 3.2 | O=C(CCc1cnn2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL483337 | 184210 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 379 | 5 | 3 | 5 | 3.2 | O=C(CCc1cnn2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 136000619 | 61445 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770352 | 61445 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 135453098 | 88734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL236162 | 88734 | 0 | None | - | 0 | Human | 9.0 | pIC50 | = | 9 | Binding | ChEMBL | 402 | 6 | 3 | 5 | 4.4 | O=C(CCc1cnc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 46890272 | 6847 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084059 | 6847 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 135800177 | 145951 | 7 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL391813 | 145951 | 7 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 135800177 | 145951 | 7 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL391813 | 145951 | 7 | None | - | 0 | Human | 8.0 | pIC50 | = | 8 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 135627640 | 61397 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 417 | 6 | 4 | 6 | 3.4 | NC(Cc1cnc(-c2ccc(O)cc2Cl)s1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770172 | 61397 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 417 | 6 | 4 | 6 | 3.4 | NC(Cc1cnc(-c2ccc(O)cc2Cl)s1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 136088959 | 61447 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 383 | 6 | 4 | 8 | 1.6 | CC(c1nc(-c2ccc(O)cn2)no1)[C@H](N)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770354 | 61447 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7 | Binding | ChEMBL | 383 | 6 | 4 | 8 | 1.6 | CC(c1nc(-c2ccc(O)cn2)no1)[C@H](N)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 44580008 | 186948 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 4.6 | Cc1c(C(=O)NCCOc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL490216 | 186948 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 414 | 7 | 1 | 5 | 4.6 | Cc1c(C(=O)NCCOc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| 156013291 | 177505 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 455 | 9 | 3 | 9 | 1.8 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCN2CCOCC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4639589 | 177505 | 0 | None | - | 0 | Human | 4.0 | pIC50 | = | 4 | Binding | ChEMBL | 455 | 9 | 3 | 9 | 1.8 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCN2CCOCC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 122181143 | 121831 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 367 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1sccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589837 | 121831 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 367 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1sccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 122181142 | 121830 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589836 | 121830 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2015.02.018 | |||
| 136000718 | 61402 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770177 | 61402 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | |||
| 11617852 | 184535 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 381 | 5 | 3 | 6 | 3.5 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL484783 | 184535 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 381 | 5 | 3 | 6 | 3.5 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 46890297 | 7214 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085653 | 7214 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 136000580 | 61449 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770356 | 61449 | 0 | None | - | 0 | Human | 8.0 | pIC50 | = | 8.0 | Binding | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| 15981408 | 94346 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL250690 | 94346 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(c2cnc3ccccc3n2)C[C@@H](C)N1C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | |||
| 156011372 | 177352 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 415 | 10 | 3 | 9 | 1.9 | COCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4637548 | 177352 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 415 | 10 | 3 | 9 | 1.9 | COCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 49862074 | 14974 | 0 | None | - | 0 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 208 | 3 | 2 | 2 | 1.9 | CCC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208921 | 14974 | 0 | None | - | 0 | Mouse | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 208 | 3 | 2 | 2 | 1.9 | CCC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899129 | 16138 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223961 | 16138 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 156012920 | 177449 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 433 | 8 | 3 | 8 | 3.0 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccncc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4638809 | 177449 | 0 | None | - | 0 | Human | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 433 | 8 | 3 | 8 | 3.0 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccncc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 44591603 | 191702 | 0 | None | - | 0 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519689 | 191702 | 0 | None | - | 0 | Mouse | 5.0 | pIC50 | = | 5.0 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 136000669 | 61404 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 382 | 7 | 4 | 7 | 1.9 | CN[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770179 | 61404 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 382 | 7 | 4 | 7 | 1.9 | CN[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 46890276 | 6531 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 464 | 7 | 3 | 6 | 3.7 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1082824 | 6531 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 464 | 7 | 3 | 6 | 3.7 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 136086828 | 7193 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 502 | 7 | 3 | 7 | 3.9 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085589 | 7193 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 502 | 7 | 3 | 7 | 3.9 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | |||
| 53238781 | 1027 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 5789 | 1027 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770358 | 1027 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 389 | 6 | 3 | 7 | 1.4 | C[C@@H]1CCC(=C(C1)NC(=O)[C@H](Cc1onc(n1)c1ccc(cn1)F)N)C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 11566404 | 145671 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 346 | 6 | 2 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL391603 | 145671 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 346 | 6 | 2 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 46890400 | 7286 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1cc(C2CCC(NC(=O)CCc3ccc4cc(O)ccc4c3)=C(C(=O)O)C2)cn1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086030 | 7286 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1cc(C2CCC(NC(=O)CCc3ccc4cc(O)ccc4c3)=C(C(=O)O)C2)cn1 | 10.1016/j.bmcl.2010.04.001 | |||
| 54585613 | 61399 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 392 | 5 | 4 | 6 | 1.9 | NC(Cc1cc2n(n1)-c1ccc(O)cc1CC2)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770174 | 61399 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 392 | 5 | 4 | 6 | 1.9 | NC(Cc1cc2n(n1)-c1ccc(O)cc1CC2)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 16048839 | 155016 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 382 | 3 | 2 | 5 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nsc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL401469 | 155016 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 382 | 3 | 2 | 5 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nsc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 4268702 | 169652 | 8 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 327 | 5 | 2 | 3 | 3.7 | CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL443733 | 169652 | 8 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 327 | 5 | 2 | 3 | 3.7 | CC(C)(C)c1ccc(OCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 11159621 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| 5784 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL456145 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| DB05939 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| 11159621 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| 5784 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL456145 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| DB05939 | 2548 | 46 | None | - | 1 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899108 | 16211 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2ccc(Cl)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224220 | 16211 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2ccc(Cl)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 122181139 | 121827 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 375 | 6 | 3 | 3 | 4.6 | Cc1cc(O)ccc1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589833 | 121827 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 375 | 6 | 3 | 3 | 4.6 | Cc1cc(O)ccc1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmc.2015.02.018 | |||
| 11494579 | 1058 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | |||
| 5791 | 1058 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | |||
| CHEMBL482768 | 1058 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(Nc1ccccc1C(=O)O)CCc1cnn2c1CCc1c2ccc(c1)O | 10.1021/jm900151e | |||
| 135416383 | 184909 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 368 | 5 | 3 | 5 | 2.7 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | |||
| CHEMBL485326 | 184909 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 368 | 5 | 3 | 5 | 2.7 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | |||
| 54580748 | 61398 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(CCc1cc2n(n1)-c1ccc(O)cc1CC2)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770173 | 61398 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 2.9 | O=C(CCc1cc2n(n1)-c1ccc(O)cc1CC2)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 137635325 | 156149 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4063682 | 156149 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 135922722 | 184191 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1CC2 | 10.1021/jm900151e | |||
| CHEMBL483160 | 184191 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1CC2 | 10.1021/jm900151e | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.030 | |||
| 135899320 | 16133 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 297 | 6 | 1 | 5 | 2.2 | O=c1[nH]c(OCCCOc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223957 | 16133 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 297 | 6 | 1 | 5 | 2.2 | O=c1[nH]c(OCCCOc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 44579762 | 187159 | 1 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)NC(C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL492020 | 187159 | 1 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)NC(C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| 49862074 | 14974 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 208 | 3 | 2 | 2 | 1.9 | CCC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208921 | 14974 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 208 | 3 | 2 | 2 | 1.9 | CCC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 11183317 | 191470 | 0 | None | - | 0 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 204 | 2 | 2 | 4 | 0.7 | CCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519338 | 191470 | 0 | None | - | 0 | Mouse | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 204 | 2 | 2 | 4 | 0.7 | CCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 136127010 | 16086 | 11 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223819 | 16086 | 11 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 46890273 | 6849 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 358 | 6 | 3 | 6 | 1.7 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)N[C@@H]1CCCC[C@@H]1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084060 | 6849 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 358 | 6 | 3 | 6 | 1.7 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)N[C@@H]1CCCC[C@@H]1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 137655320 | 158538 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4091501 | 158538 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 46890274 | 6906 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.4 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC[C@@H](C)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084332 | 6906 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.4 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC[C@@H](C)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890399 | 7285 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086029 | 7285 | 0 | None | - | 0 | Human | 7.9 | pIC50 | = | 7.9 | Binding | ChEMBL | 419 | 6 | 3 | 5 | 3.6 | Cn1nccc1C1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 135401973 | 1022 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | |||
| 5792 | 1022 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL398496 | 1022 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | Oc1ccc2c(c1)ncc(n2)N1CCN(CC1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2007.10.055 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2007.10.055 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 11594881 | 88638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL235740 | 88638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm900151e | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.04.001 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.06.054 | |||
| 117629482 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 1588 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 1594 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 2835 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 938 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| CHEMBL573 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| DB00627 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm700942d | |||
| 11594881 | 88638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL235740 | 88638 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 319 | 5 | 2 | 2 | 4.1 | O=C(CCc1ccc2ccccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002517 | 191882 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519966 | 191882 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002525 | 192343 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1F | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520676 | 192343 | 0 | None | - | 0 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1F | 10.1016/j.bmcl.2009.03.014 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 117629482 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 1588 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 1594 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 2835 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 938 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL573 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| DB00627 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002522 | 188456 | 0 | None | - | 0 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL502716 | 188456 | 0 | None | - | 0 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 117629482 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 1588 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 1594 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 2835 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 938 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL573 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| DB00627 | 2823 | 140 | None | - | 2 | Mouse | 6.9 | pIC50 | = | 6.9 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899171 | 16170 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224070 | 16170 | 0 | None | - | 0 | Rat | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 122181102 | 121810 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2cccc(Cl)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589784 | 121810 | 0 | None | - | 0 | Human | 5.9 | pIC50 | = | 5.9 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2cccc(Cl)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 46890302 | 7252 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 500 | 7 | 3 | 6 | 4.0 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cc(F)c(F)c(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085842 | 7252 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 500 | 7 | 3 | 6 | 4.0 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cc(F)c(F)c(F)c2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890198 | 7317 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.6 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086108 | 7317 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.6 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890578 | 6391 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 505 | 7 | 3 | 7 | 3.0 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1082294 | 6391 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 505 | 7 | 3 | 7 | 3.0 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 135899171 | 16170 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224070 | 16170 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 52941721 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1204125 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1615577 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| 12002717 | 196742 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 302 | 2 | 2 | 4 | 2.1 | Fc1ccc(F)c(C2CCc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL565163 | 196742 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 302 | 2 | 2 | 4 | 2.1 | Fc1ccc(F)c(C2CCc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.06.054 | |||
| 52941721 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1204125 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1615577 | 54965 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 283 | 1 | 0 | 7 | 4.2 | Fc1ncccc1C1CCC2=C(C1)C(=C1N=NN=N1)N=N2 | 10.1016/j.bmcl.2009.06.054 | |||
| 54587625 | 61396 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 6 | 4 | 4 | 3.3 | N[C@@H](Cc1ccc(-c2ccc(O)cc2)cc1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770171 | 61396 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 376 | 6 | 4 | 4 | 3.3 | N[C@@H](Cc1ccc(-c2ccc(O)cc2)cc1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 11852982 | 14975 | 0 | None | - | 0 | Mouse | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 228 | 2 | 2 | 2 | 2.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208922 | 14975 | 0 | None | - | 0 | Mouse | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 228 | 2 | 2 | 2 | 2.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 11159621 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| 5784 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL456145 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| DB05939 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2009.03.014 | |||
| 11159621 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| 5784 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL456145 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| DB05939 | 2548 | 46 | None | - | 1 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899199 | 16227 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1cccc(CCOCc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224293 | 16227 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1cccc(CCOCc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| 136088957 | 61403 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770178 | 61403 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 2.2 | N[C@@H](CC(=O)Nc1ccccc1C(=O)O)c1nc(-c2ccc(O)cc2)no1 | 10.1016/j.bmcl.2010.11.116 | |||
| 24811550 | 6680 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083450 | 6680 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 11624691 | 7227 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1085711 | 7227 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 137640776 | 157004 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 313 | 3 | 2 | 2 | 2.8 | O=C(/C=C/C#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4073322 | 157004 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 313 | 3 | 2 | 2 | 2.8 | O=C(/C=C/C#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 44445341 | 154248 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 376 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)C1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL398625 | 154248 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 376 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)C1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 156022048 | 178201 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 383 | 7 | 3 | 8 | 2.2 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(C2CC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4649587 | 178201 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 383 | 7 | 3 | 8 | 2.2 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(C2CC2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 12002619 | 184180 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c(F)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL483141 | 184180 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c(F)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003695 | 14979 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | Cn1cc(C2Cc3[nH]nc(C(=O)O)c3C2)cn1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208926 | 14979 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | Cn1cc(C2Cc3[nH]nc(C(=O)O)c3C2)cn1 | 10.1016/j.bmcl.2010.06.041 | |||
| 44591603 | 191702 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519689 | 191702 | 0 | None | - | 0 | Human | 4.8 | pIC50 | = | 4.8 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135502978 | 191989 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 377 | 5 | 4 | 4 | 3.2 | O=C(CCc1[nH]nc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL520136 | 191989 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 377 | 5 | 4 | 4 | 3.2 | O=C(CCc1[nH]nc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 25101223 | 1152 | 7 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 5795 | 1152 | 7 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL490599 | 1152 | 7 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | C[C@@H](NC(=O)c1cnc2n(c1C)ncc2c1ccc(cc1)C(C)C)COc1ccccc1 | 10.1016/j.bmcl.2008.08.039 | |||
| 49862073 | 14973 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 194 | 2 | 2 | 2 | 1.5 | CC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208920 | 14973 | 1 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 194 | 2 | 2 | 2 | 1.5 | CC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 12002520 | 184153 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL482943 | 184153 | 0 | None | - | 0 | Mouse | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135899152 | 16226 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1ccccc1CCOCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224292 | 16226 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1ccccc1CCOCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| 11646179 | 184813 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 359 | 5 | 3 | 3 | 4.0 | O=C(CCc1ccc2c(ccc3[nH]ncc32)c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL485185 | 184813 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 359 | 5 | 3 | 3 | 4.0 | O=C(CCc1ccc2c(ccc3[nH]ncc32)c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 46890328 | 6681 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 484 | 6 | 3 | 4 | 5.3 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(C(F)(F)F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083451 | 6681 | 0 | None | - | 0 | Human | 7.8 | pIC50 | = | 7.8 | Binding | ChEMBL | 484 | 6 | 3 | 4 | 5.3 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(C(F)(F)F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 156021045 | 178131 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4648435 | 178131 | 0 | None | - | 0 | Human | 6.8 | pIC50 | = | 6.8 | Binding | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 156017210 | 177730 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 414 | 8 | 4 | 3 | 5.1 | CCCCc1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)[nH]1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4642367 | 177730 | 0 | None | - | 0 | Human | 5.8 | pIC50 | = | 5.8 | Binding | ChEMBL | 414 | 8 | 4 | 3 | 5.1 | CCCCc1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)[nH]1 | 10.1016/j.bmcl.2020.127105 | |||
| 11625092 | 6684 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1083473 | 6684 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 46890539 | 7040 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 472 | 7 | 2 | 6 | 3.9 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084841 | 7040 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 472 | 7 | 2 | 6 | 3.9 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 136375455 | 177554 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 385 | 7 | 3 | 8 | 2.5 | CC(C)n1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4640349 | 177554 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 385 | 7 | 3 | 8 | 2.5 | CC(C)n1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 12002523 | 171949 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL447050 | 171949 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003601 | 14980 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 218 | 2 | 2 | 4 | 0.6 | O=C(O)c1n[nH]c2c1CC(n1cccn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208987 | 14980 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 218 | 2 | 2 | 4 | 0.6 | O=C(O)c1n[nH]c2c1CC(n1cccn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899263 | 16112 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 307 | 7 | 1 | 3 | 3.7 | O=c1[nH]c(CCCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223875 | 16112 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 307 | 7 | 1 | 3 | 3.7 | O=c1[nH]c(CCCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 156021045 | 178131 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4648435 | 178131 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 399 | 9 | 3 | 8 | 2.7 | CCCCn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 24741312 | 89399 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 2.3 | O=C(CCc1cnc(-n2cc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL237036 | 89399 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 2.3 | O=C(CCc1cnc(-n2cc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 136088961 | 61450 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | CC1CCC(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770357 | 61450 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 387 | 6 | 4 | 8 | 1.0 | CC1CCC(NC(=O)[C@@H](N)Cc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| 12003490 | 14976 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 282 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208923 | 14976 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 282 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 12003791 | 194829 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237147 | 194829 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL539398 | 194829 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 11852982 | 14975 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 228 | 2 | 2 | 2 | 2.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208922 | 14975 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 228 | 2 | 2 | 2 | 2.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 16048997 | 94657 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 394 | 3 | 2 | 4 | 3.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2c(Cl)cncc2Cl)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252507 | 94657 | 0 | None | - | 0 | Human | 4.7 | pIC50 | = | 4.7 | Binding | ChEMBL | 394 | 3 | 2 | 4 | 3.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2c(Cl)cncc2Cl)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 122181105 | 121817 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 375 | 6 | 3 | 3 | 4.6 | Cc1cc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)ccc1O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589791 | 121817 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 375 | 6 | 3 | 3 | 4.6 | Cc1cc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)ccc1O | 10.1016/j.bmc.2015.02.018 | |||
| 11493732 | 193100 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL522649 | 193100 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 54584718 | 61451 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 374 | 6 | 2 | 6 | 2.5 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770359 | 61451 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 374 | 6 | 2 | 6 | 2.5 | C[C@@H]1CCC(C(=O)O)=C(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)C1 | 10.1016/j.bmcl.2010.11.116 | |||
| 122181142 | 121830 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL3589836 | 121830 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 11736428 | 189063 | 0 | None | - | 0 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL509541 | 189063 | 0 | None | - | 0 | Mouse | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 16048992 | 94682 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 403 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252707 | 94682 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 403 | 4 | 2 | 5 | 3.2 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc(-c3ccccc3)n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 135922719 | 184287 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 3.0 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1C2 | 10.1021/jm900151e | |||
| CHEMBL483996 | 184287 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 377 | 5 | 3 | 5 | 3.0 | Cn1nc(CCC(=O)Nc2ccccc2C(=O)O)c2c1-c1ccc(O)cc1C2 | 10.1021/jm900151e | |||
| 12003695 | 14979 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | Cn1cc(C2Cc3[nH]nc(C(=O)O)c3C2)cn1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208926 | 14979 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | Cn1cc(C2Cc3[nH]nc(C(=O)O)c3C2)cn1 | 10.1016/j.bmcl.2010.06.041 | |||
| 46890239 | 6934 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1cnn(-c2ccc(O)cn2)c1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1084448 | 6934 | 0 | None | - | 0 | Human | 7.7 | pIC50 | = | 7.7 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | CC(Cc1cnn(-c2ccc(O)cn2)c1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 12003788 | 194941 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237148 | 194941 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL542000 | 194941 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 136375410 | 177317 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 370 | 7 | 3 | 7 | 2.5 | CCn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4636989 | 177317 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 370 | 7 | 3 | 7 | 2.5 | CCn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 135899322 | 16192 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccccc2F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224146 | 16192 | 0 | None | - | 0 | Human | 6.7 | pIC50 | = | 6.7 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccccc2F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 16048923 | 94656 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252506 | 94656 | 0 | None | - | 0 | Human | 5.7 | pIC50 | = | 5.7 | Binding | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nccc3ccccc23)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 137661033 | 159487 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4101720 | 159487 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 313 | 4 | 3 | 3 | 2.6 | O=C(CCC#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 122181140 | 121828 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 4.5 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589834 | 121828 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 4.5 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 15986930 | 184910 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 371 | 5 | 3 | 6 | 2.8 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | |||
| CHEMBL485327 | 184910 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 371 | 5 | 3 | 6 | 2.8 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCC1 | 10.1021/jm900151e | |||
| 156019027 | 177797 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(C(=O)O)c(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)n1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4643451 | 177797 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(C(=O)O)c(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)n1 | 10.1016/j.bmcl.2020.127105 | |||
| 135899198 | 15591 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2cccc(F)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1221438 | 15591 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2cccc(F)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899170 | 16172 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccc(Cl)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224072 | 16172 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2ccc(Cl)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 24741307 | 88735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL236163 | 88735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 24741307 | 88735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1021/jm700942d | |||
| CHEMBL236163 | 88735 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 365 | 6 | 3 | 5 | 3.2 | Cc1c(CCC(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1021/jm700942d | |||
| 11660694 | 178068 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647392 | 178068 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 11493732 | 193100 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL522649 | 193100 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 335 | 5 | 3 | 3 | 3.8 | O=C(CCc1ccc2cc(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2008.08.030 | |||
| 12003596 | 14977 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1cccs1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208924 | 14977 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1cccs1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 12002619 | 184180 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c(F)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL483141 | 184180 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c(F)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmc.2015.02.018 | |||
| 46890197 | 7259 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.5 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085875 | 7259 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 366 | 6 | 3 | 6 | 2.5 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 137633734 | 156321 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4065654 | 156321 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccc(O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 49862072 | 14972 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 194 | 3 | 2 | 2 | 1.6 | CCCC1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208919 | 14972 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 194 | 3 | 2 | 2 | 1.6 | CCCC1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 12003596 | 14977 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1cccs1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208924 | 14977 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1cccs1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 135899131 | 16135 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2ccccc2F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223959 | 16135 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2ccccc2F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 16048998 | 94632 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252307 | 94632 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 376 | 3 | 2 | 4 | 3.3 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 11299550 | 192007 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 244 | 2 | 2 | 4 | 1.5 | C1CCC(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520159 | 192007 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 244 | 2 | 2 | 4 | 1.5 | C1CCC(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 44591602 | 188384 | 0 | None | - | 0 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 216 | 2 | 2 | 4 | 0.7 | C1CC1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL501585 | 188384 | 0 | None | - | 0 | Mouse | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 216 | 2 | 2 | 4 | 0.7 | C1CC1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 15986936 | 7101 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1cnn(-c2ccc(O)cn2)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085150 | 7101 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1cnn(-c2ccc(O)cn2)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 15986929 | 7159 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 383 | 6 | 3 | 5 | 3.1 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085402 | 7159 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 383 | 6 | 3 | 5 | 3.1 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 135800176 | 89400 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1cnc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL237037 | 89400 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1cnc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 46890164 | 7422 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086568 | 7422 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1cnn(-c2ccccc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 11424509 | 188288 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 218 | 3 | 2 | 4 | 1.1 | CCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL500239 | 188288 | 0 | None | - | 0 | Mouse | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 218 | 3 | 2 | 4 | 1.1 | CCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 156021546 | 178186 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 401 | 9 | 4 | 9 | 1.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4649305 | 178186 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 401 | 9 | 4 | 9 | 1.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 12003785 | 196379 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 260 | 2 | 2 | 2 | 2.5 | O=C(O)c1n[nH]c2c1CC(c1ccccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL562632 | 196379 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 260 | 2 | 2 | 2 | 2.5 | O=C(O)c1n[nH]c2c1CC(c1ccccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 12002520 | 184153 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL482943 | 184153 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135899325 | 16193 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224147 | 16193 | 0 | None | - | 0 | Rat | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 17751630 | 6745 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 487 | 7 | 3 | 7 | 2.8 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083743 | 6745 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 487 | 7 | 3 | 7 | 2.8 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 137635425 | 155922 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 331 | 4 | 3 | 3 | 2.7 | O=C(CCC#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4060899 | 155922 | 0 | None | - | 0 | Human | 7.6 | pIC50 | = | 7.6 | Binding | ChEMBL | 331 | 4 | 3 | 3 | 2.7 | O=C(CCC#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 46890579 | 7016 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 7 | 2 | 7 | 3.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084798 | 7016 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 455 | 7 | 2 | 7 | 3.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 137662135 | 159350 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 367 | 6 | 2 | 2 | 4.5 | O=C(CCc1ccc(-c2ccccc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4100231 | 159350 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 367 | 6 | 2 | 2 | 4.5 | O=C(CCc1ccc(-c2ccccc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 137645601 | 157851 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 299 | 6 | 2 | 2 | 3.2 | O=C(/C=C/CCc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4083723 | 157851 | 0 | None | - | 0 | Human | 5.6 | pIC50 | = | 5.6 | Binding | ChEMBL | 299 | 6 | 2 | 2 | 3.2 | O=C(/C=C/CCc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 11559598 | 121811 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2cccc(F)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589785 | 121811 | 0 | None | - | 0 | Human | 6.6 | pIC50 | = | 6.6 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2cccc(F)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 11660694 | 178068 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647392 | 178068 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 369 | 5 | 3 | 3 | 4.5 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 11617151 | 88639 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL235741 | 88639 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 16048919 | 94683 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc12 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252708 | 94683 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 407 | 4 | 2 | 6 | 2.7 | COc1cccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc12 | 10.1016/j.bmcl.2007.10.055 | |||
| 12002522 | 188456 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL502716 | 188456 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 137653428 | 158543 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccc(F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4091542 | 158543 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccc(F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 42625474 | 184178 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 380 | 5 | 3 | 5 | 3.6 | O=C(CCc1noc2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL483139 | 184178 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 380 | 5 | 3 | 5 | 3.6 | O=C(CCc1noc2c1ccc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 42625379 | 192091 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 376 | 5 | 3 | 5 | 4.0 | O=C(CCc1noc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL520299 | 192091 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 376 | 5 | 3 | 5 | 4.0 | O=C(CCc1noc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 46890327 | 6600 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 6 | 3 | 3 | 5.2 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083138 | 6600 | 0 | None | - | 0 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 451 | 6 | 3 | 3 | 5.2 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 8.5 | pIC50 | = | 8.5 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | |||
| 12003490 | 14976 | 0 | None | - | 0 | Mouse | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 282 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208923 | 14976 | 0 | None | - | 0 | Mouse | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 282 | 2 | 2 | 2 | 2.4 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 42625213 | 192303 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 365 | 5 | 2 | 5 | 3.8 | O=C(CCc1cn2c(n1)sc1ccccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL520620 | 192303 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 365 | 5 | 2 | 5 | 3.8 | O=C(CCc1cn2c(n1)sc1ccccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 46890163 | 7421 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1ccn(-c2ccccc2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086567 | 7421 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 335 | 6 | 2 | 4 | 3.1 | O=C(CCc1ccn(-c2ccccc2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 12003879 | 192342 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 252 | 2 | 2 | 4 | 1.5 | c1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520675 | 192342 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 252 | 2 | 2 | 4 | 1.5 | c1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 156020475 | 178074 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 8 | 3 | 5 | 4.5 | CCCCc1nc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1C | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647545 | 178074 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 429 | 8 | 3 | 5 | 4.5 | CCCCc1nc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1C | 10.1016/j.bmcl.2020.127105 | |||
| 12002523 | 171949 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL447050 | 171949 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 46890165 | 7314 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 351 | 6 | 3 | 5 | 2.8 | O=C(CCc1cnn(-c2ccc(O)cc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086103 | 7314 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 351 | 6 | 3 | 5 | 2.8 | O=C(CCc1cnn(-c2ccc(O)cc2)c1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 46890501 | 7246 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 375 | 6 | 3 | 7 | 1.2 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085816 | 7246 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 375 | 6 | 3 | 7 | 1.2 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 137647495 | 157856 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4083762 | 157856 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 11508815 | 121807 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2ccc(F)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589779 | 121807 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2ccc(F)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 122181104 | 121815 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 413 | 6 | 2 | 2 | 5.6 | O=C(CCc1ccc(-c2ccccc2C(F)(F)F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589789 | 121815 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 413 | 6 | 2 | 2 | 5.6 | O=C(CCc1ccc(-c2ccccc2C(F)(F)F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 90645405 | 112533 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL3299113 | 112533 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 295 | 3 | 2 | 2 | 2.6 | O=C(/C=C/C#Cc1ccccc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 136127016 | 16171 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224071 | 16171 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 331 | 6 | 1 | 5 | 2.8 | O=c1[nH]c(OCCCOc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135800175 | 88736 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nnc(-c2ccc(O)cc2)o1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL236164 | 88736 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nnc(-c2ccc(O)cc2)o1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 44579763 | 186983 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)N[C@@H](C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL490600 | 186983 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 428 | 7 | 1 | 5 | 5.0 | Cc1c(C(=O)N[C@@H](C)COc2ccccc2)cnc2c(-c3ccc(C(C)C)cc3)cnn12 | 10.1016/j.bmcl.2008.08.039 | |||
| 137652577 | 158760 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 329 | 3 | 3 | 3 | 2.5 | O=C(/C=C/C#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4093990 | 158760 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 329 | 3 | 3 | 3 | 2.5 | O=C(/C=C/C#Cc1ccc(O)cc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 11560300 | 88539 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL235256 | 88539 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 24811547 | 7376 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 6 | 3 | 3 | 4.9 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086355 | 7376 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 415 | 6 | 3 | 3 | 4.9 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccccc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 11638560 | 187043 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 334 | 5 | 3 | 3 | 3.7 | Nc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL491002 | 187043 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 334 | 5 | 3 | 3 | 3.7 | Nc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| 42625382 | 184812 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 416 | 5 | 3 | 5 | 3.7 | Cn1c(=O)c2cc(O)ccc2c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc21 | 10.1021/jm900151e | |||
| CHEMBL485184 | 184812 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 416 | 5 | 3 | 5 | 3.7 | Cn1c(=O)c2cc(O)ccc2c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc21 | 10.1021/jm900151e | |||
| 11736428 | 189063 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL509541 | 189063 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003880 | 188734 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL504980 | 188734 | 0 | None | - | 0 | Mouse | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 44580007 | 186947 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 366 | 6 | 1 | 5 | 3.6 | COCC(C)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | |||
| CHEMBL490215 | 186947 | 0 | None | - | 0 | Human | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 366 | 6 | 1 | 5 | 3.6 | COCC(C)NC(=O)c1cnc2c(-c3ccc(C(C)C)cc3)cnn2c1C | 10.1016/j.bmcl.2008.08.039 | |||
| 12003601 | 14980 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 218 | 2 | 2 | 4 | 0.6 | O=C(O)c1n[nH]c2c1CC(n1cccn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208987 | 14980 | 0 | None | - | 0 | Mouse | 5.5 | pIC50 | = | 5.5 | Binding | ChEMBL | 218 | 2 | 2 | 4 | 0.6 | O=C(O)c1n[nH]c2c1CC(n1cccn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 135399731 | 184157 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc2c(c1CCC(=O)Nc1ccccc1C(=O)O)CCc1cc(O)ccc1-2 | 10.1021/jm900151e | |||
| CHEMBL482963 | 184157 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 391 | 5 | 3 | 5 | 3.2 | Cn1nc2c(c1CCC(=O)Nc1ccccc1C(=O)O)CCc1cc(O)ccc1-2 | 10.1021/jm900151e | |||
| 46890500 | 7245 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 360 | 6 | 2 | 6 | 2.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085815 | 7245 | 0 | None | - | 0 | Human | 7.5 | pIC50 | = | 7.5 | Binding | ChEMBL | 360 | 6 | 2 | 6 | 2.2 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 24741306 | 166956 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 334 | 6 | 3 | 2 | 4.0 | O=C(CCc1ccc(-c2ccc[nH]2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL428724 | 166956 | 0 | None | - | 0 | Human | 6.5 | pIC50 | = | 6.5 | Binding | ChEMBL | 334 | 6 | 3 | 2 | 4.0 | O=C(CCc1ccc(-c2ccc[nH]2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 46890401 | 7287 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 460 | 7 | 3 | 4 | 4.9 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086031 | 7287 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 460 | 7 | 3 | 4 | 4.9 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 42625380 | 184411 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 407 | 5 | 3 | 8 | 1.6 | Cn1c(=O)c2c(CCC(=O)Nc3ccccc3C(=O)O)nnn2c2ccc(O)cc21 | 10.1021/jm900151e | |||
| CHEMBL484605 | 184411 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 407 | 5 | 3 | 8 | 1.6 | Cn1c(=O)c2c(CCC(=O)Nc3ccccc3C(=O)O)nnn2c2ccc(O)cc21 | 10.1021/jm900151e | |||
| 44591586 | 184161 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 246 | 5 | 2 | 4 | 1.9 | CCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL482979 | 184161 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 246 | 5 | 2 | 4 | 1.9 | CCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 137648318 | 157632 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 341 | 5 | 3 | 3 | 2.5 | O=C(CCC#Cc1ccc(C(=O)O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4081260 | 157632 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 341 | 5 | 3 | 3 | 2.5 | O=C(CCC#Cc1ccc(C(=O)O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 122181106 | 121818 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)c(Cl)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589792 | 121818 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)c(Cl)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 137632012 | 156656 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4069406 | 156656 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1ccccc1O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 12003791 | 194829 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237147 | 194829 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL539398 | 194829 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 136127015 | 16132 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 279 | 4 | 1 | 4 | 2.4 | O=c1[nH]c(OC/C=C/c2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223956 | 16132 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 279 | 4 | 1 | 4 | 2.4 | O=c1[nH]c(OC/C=C/c2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899149 | 16137 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2cccc(F)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223960 | 16137 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 315 | 6 | 1 | 5 | 2.3 | O=c1[nH]c(OCCCOc2cccc(F)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135922723 | 184162 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 364 | 5 | 3 | 5 | 3.2 | O=C(CCc1noc2c1Cc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL482980 | 184162 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 364 | 5 | 3 | 5 | 3.2 | O=C(CCc1noc2c1Cc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 49862072 | 14972 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 194 | 3 | 2 | 2 | 1.6 | CCCC1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208919 | 14972 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 194 | 3 | 2 | 2 | 1.6 | CCCC1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 137654580 | 159022 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4096635 | 159022 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 311 | 3 | 3 | 3 | 2.3 | O=C(/C=C/C#Cc1cccc(O)c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 12003694 | 1144 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| 5793 | 1144 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208986 | 1144 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| 156017987 | 177919 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 358 | 5 | 3 | 4 | 3.4 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nn1cccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4645273 | 177919 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 358 | 5 | 3 | 4 | 3.4 | O=C(CCc1ccc2c(Cl)c(O)ccc2c1)Nn1cccc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 11560300 | 88539 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL235256 | 88539 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 11560300 | 88539 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL235256 | 88539 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 395 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 135466520 | 184217 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 378 | 5 | 3 | 5 | 3.4 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL483353 | 184217 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 378 | 5 | 3 | 5 | 3.4 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 135416384 | 184824 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 382 | 5 | 3 | 5 | 3.1 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL485196 | 184824 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 382 | 5 | 3 | 5 | 3.1 | O=C(CCc1noc2c1CCc1cc(O)ccc1-2)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 136086823 | 6969 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 400 | 8 | 3 | 7 | 2.8 | CCCC1CCC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084576 | 6969 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 400 | 8 | 3 | 7 | 2.8 | CCCC1CCC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 136088958 | 61446 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770353 | 61446 | 0 | None | - | 0 | Human | 8.4 | pIC50 | = | 8.4 | Binding | ChEMBL | 369 | 6 | 4 | 8 | 1.0 | N[C@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Mouse | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Mouse | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 137650474 | 157279 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccc2O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4076822 | 157279 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 365 | 6 | 3 | 3 | 4.0 | O=C(CCc1ccc(-c2ccccc2O)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 12003788 | 194941 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237148 | 194941 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL542000 | 194941 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 136127010 | 16086 | 11 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223819 | 16086 | 11 | None | - | 0 | Rat | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 215 | 0 | 1 | 3 | 1.3 | O=c1[nH]c(C(F)(F)F)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 156020831 | 178070 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 386 | 8 | 4 | 8 | 1.5 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647398 | 178070 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 386 | 8 | 4 | 8 | 1.5 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(CCO)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 12003692 | 14981 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 219 | 2 | 2 | 5 | 0.0 | O=C(O)c1n[nH]c2c1CC(n1ccnn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208988 | 14981 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 219 | 2 | 2 | 5 | 0.0 | O=C(O)c1n[nH]c2c1CC(n1ccnn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 44591604 | 184823 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL485195 | 184823 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 136088962 | 61401 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770176 | 61401 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 156016157 | 177778 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 430 | 8 | 3 | 4 | 3.2 | CCCCN1CC(C(=O)O)=C(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)C1=O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4643073 | 177778 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 430 | 8 | 3 | 4 | 3.2 | CCCCN1CC(C(=O)O)=C(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)C1=O | 10.1016/j.bmcl.2020.127105 | |||
| 12003880 | 188734 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL504980 | 188734 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 136127017 | 16213 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1cccc(CCOCc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224222 | 16213 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1cccc(CCOCc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| 136000579 | 61400 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770175 | 61400 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 368 | 6 | 4 | 7 | 1.6 | N[C@@H](Cc1nc(-c2ccc(O)cc2)no1)C(=O)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 46890271 | 7377 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 355 | 5 | 4 | 4 | 2.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(O)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086356 | 7377 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 355 | 5 | 4 | 4 | 2.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(O)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12002521 | 184821 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL485194 | 184821 | 0 | None | - | 0 | Mouse | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 46890268 | 6606 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 353 | 5 | 3 | 3 | 3.8 | CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083174 | 6606 | 0 | None | - | 0 | Human | 7.4 | pIC50 | = | 7.4 | Binding | ChEMBL | 353 | 5 | 3 | 3 | 3.8 | CC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12003879 | 192342 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 252 | 2 | 2 | 4 | 1.5 | c1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520675 | 192342 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 252 | 2 | 2 | 4 | 1.5 | c1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135899109 | 16214 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1ccc(CCOCc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224223 | 16214 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1ccc(CCOCc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899153 | 16212 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1ccccc1CCOCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224221 | 16212 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 295 | 5 | 1 | 4 | 2.4 | Cc1ccccc1CCOCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899247 | 16088 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 279 | 5 | 1 | 3 | 2.9 | O=c1[nH]c(CCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223823 | 16088 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 279 | 5 | 1 | 3 | 2.9 | O=c1[nH]c(CCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899110 | 16228 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1ccc(CCOCc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224294 | 16228 | 0 | None | - | 0 | Human | 5.4 | pIC50 | = | 5.4 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.1 | COc1ccc(CCOCc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| 12003694 | 1144 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| 5793 | 1144 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208986 | 1144 | 0 | None | - | 0 | Mouse | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 232 | 2 | 2 | 4 | 0.7 | OC(=O)c1n[nH]c2c1CC(C2)c1ccnn1C | 10.1016/j.bmcl.2010.06.041 | |||
| 135812996 | 16173 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1ccccc1OCCCOc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224073 | 16173 | 0 | None | - | 0 | Human | 6.4 | pIC50 | = | 6.4 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1ccccc1OCCCOc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| 46890238 | 7100 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.5 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085149 | 7100 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 384 | 6 | 3 | 6 | 2.5 | Cc1c(CC(C)C(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 12003790 | 196055 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 276 | 2 | 2 | 2 | 3.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1Cl)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL560406 | 196055 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 276 | 2 | 2 | 2 | 3.0 | O=C(O)c1n[nH]c2c1CC(c1ccccc1Cl)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 135800177 | 145951 | 7 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL391813 | 145951 | 7 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 353 | 6 | 3 | 6 | 2.7 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 156016715 | 177675 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4641756 | 177675 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 415 | 8 | 3 | 5 | 4.5 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)n1 | 10.1016/j.bmcl.2020.127105 | |||
| 11183317 | 191470 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 204 | 2 | 2 | 4 | 0.7 | CCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519338 | 191470 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 204 | 2 | 2 | 4 | 0.7 | CCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135899130 | 16175 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1ccc(OCCCOc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224075 | 16175 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1ccc(OCCCOc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| 44591586 | 184161 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 246 | 5 | 2 | 4 | 1.9 | CCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL482979 | 184161 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 246 | 5 | 2 | 4 | 1.9 | CCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 136127012 | 16113 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 321 | 8 | 1 | 3 | 4.1 | O=c1[nH]c(CCCCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223876 | 16113 | 0 | None | - | 0 | Human | 4.3 | pIC50 | = | 4.3 | Binding | ChEMBL | 321 | 8 | 1 | 3 | 4.1 | O=c1[nH]c(CCCCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 46890240 | 7103 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085156 | 7103 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 356 | 6 | 3 | 6 | 1.9 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 46890301 | 7199 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085616 | 7199 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.013 | |||
| 11516324 | 184216 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 375 | 5 | 4 | 4 | 3.7 | O=C(CCc1[nH]nc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL483352 | 184216 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 375 | 5 | 4 | 4 | 3.7 | O=C(CCc1[nH]nc2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 15986931 | 192236 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 385 | 5 | 3 | 6 | 3.2 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL520513 | 192236 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 385 | 5 | 3 | 6 | 3.2 | O=C(CCc1cn2c(n1)sc1cc(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 136088960 | 61448 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 6 | 4 | 8 | 0.7 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL1770355 | 61448 | 0 | None | - | 0 | Human | 8.3 | pIC50 | = | 8.3 | Binding | ChEMBL | 373 | 6 | 4 | 8 | 0.7 | N[C@@H](Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.11.116 | |||
| 135899178 | 16210 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224219 | 16210 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 12002802 | 195833 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 285 | 2 | 2 | 5 | 1.4 | Fc1ncccc1C1CCc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL558334 | 195833 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 285 | 2 | 2 | 5 | 1.4 | Fc1ncccc1C1CCc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.06.054 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1016/j.bmcl.2020.127105 | |||
| 44591604 | 184823 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL485195 | 184823 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 286 | 2 | 2 | 4 | 2.1 | Clc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1 | 10.1016/j.bmcl.2009.03.014 | |||
| 11610363 | 89490 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1ncc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL237247 | 89490 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 369 | 6 | 3 | 6 | 3.2 | O=C(CCc1ncc(-c2ccc(O)cn2)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 156010038 | 177030 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4632359 | 177030 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 24811199 | 6601 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083139 | 6601 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 434 | 6 | 3 | 4 | 4.4 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccnc2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12002524 | 191782 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1F | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519811 | 191782 | 0 | None | - | 0 | Mouse | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1F | 10.1016/j.bmcl.2009.03.014 | |||
| 44591602 | 188384 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 216 | 2 | 2 | 4 | 0.7 | C1CC1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL501585 | 188384 | 0 | None | - | 0 | Human | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 216 | 2 | 2 | 4 | 0.7 | C1CC1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003692 | 14981 | 0 | None | - | 0 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 219 | 2 | 2 | 5 | 0.0 | O=C(O)c1n[nH]c2c1CC(n1ccnn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208988 | 14981 | 0 | None | - | 0 | Mouse | 5.3 | pIC50 | = | 5.3 | Binding | ChEMBL | 219 | 2 | 2 | 5 | 0.0 | O=C(O)c1n[nH]c2c1CC(n1ccnn1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 44579742 | 187044 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 347 | 6 | 2 | 3 | 3.9 | O=Cc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL491003 | 187044 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 347 | 6 | 2 | 3 | 3.9 | O=Cc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| 16048770 | 94631 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252306 | 94631 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 377 | 3 | 2 | 5 | 2.7 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 156013148 | 177468 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 356 | 6 | 3 | 7 | 2.1 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4639053 | 177468 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 356 | 6 | 3 | 7 | 2.1 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cc3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 11523335 | 121813 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 359 | 6 | 2 | 2 | 4.9 | Cc1ccccc1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589787 | 121813 | 0 | None | - | 0 | Human | 6.3 | pIC50 | = | 6.3 | Binding | ChEMBL | 359 | 6 | 2 | 2 | 4.9 | Cc1ccccc1-c1ccc(CCC(=O)Nc2ccccc2C(=O)O)cc1 | 10.1016/j.bmc.2015.02.018 | |||
| 137661636 | 159263 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 331 | 4 | 2 | 2 | 3.5 | O=C(CCC#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4099238 | 159263 | 0 | None | - | 0 | Human | 7.3 | pIC50 | = | 7.3 | Binding | ChEMBL | 331 | 4 | 2 | 2 | 3.5 | O=C(CCC#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 46890537 | 7038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 454 | 7 | 2 | 6 | 3.8 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084839 | 7038 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 454 | 7 | 2 | 6 | 3.8 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 16048921 | 155017 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 366 | 3 | 2 | 5 | 2.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nc3ccccc3o2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL401470 | 155017 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 366 | 3 | 2 | 5 | 2.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2nc3ccccc3o2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 122181141 | 121829 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 377 | 6 | 4 | 4 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2O)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589835 | 121829 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 377 | 6 | 4 | 4 | 4.0 | O=C(CCc1ccc(-c2ccc(O)cc2O)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 24741310 | 89622 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL237543 | 89622 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.04.013 | |||
| 24741310 | 89622 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL237543 | 89622 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 352 | 6 | 3 | 6 | 2.2 | O=C(CCc1ccn(-c2ccc(O)cn2)n1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 137637662 | 156241 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 383 | 6 | 3 | 3 | 4.2 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4064786 | 156241 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 383 | 6 | 3 | 3 | 4.2 | O=C(CCc1ccc(-c2ccc(O)cc2F)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 135899244 | 16111 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 293 | 6 | 1 | 3 | 3.3 | O=c1[nH]c(CCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223874 | 16111 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 293 | 6 | 1 | 3 | 3.3 | O=c1[nH]c(CCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 46890300 | 7415 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2F)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086541 | 7415 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 482 | 7 | 3 | 6 | 3.9 | CC(Cc1ccn(-c2ccc(O)cn2)n1)C(=O)NC1=C(C(=O)O)CCC(c2cccc(F)c2F)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 42625218 | 184179 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 5 | 3 | 5 | 3.8 | O=C(CCc1noc2c1ccc1c(F)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| CHEMBL483140 | 184179 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 398 | 5 | 3 | 5 | 3.8 | O=C(CCc1noc2c1ccc1c(F)c(O)ccc12)NC1=C(C(=O)O)CCCC1 | 10.1021/jm900151e | |||
| 46890580 | 7017 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 504 | 7 | 2 | 6 | 4.3 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084799 | 7017 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 504 | 7 | 2 | 6 | 4.3 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(F)cn3)no2)=C(C(=O)O)C[C@H]1c1cc(F)cc(F)c1F | 10.1016/j.bmcl.2010.04.001 | |||
| 46890270 | 7375 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 395 | 8 | 3 | 3 | 4.9 | CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086354 | 7375 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 395 | 8 | 3 | 3 | 4.9 | CCCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1016/j.bmcl.2010.11.116 | |||
| 11736428 | 189063 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL509541 | 189063 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003791 | 194829 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237147 | 194829 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL539398 | 194829 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 135899154 | 16209 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224218 | 16209 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2ccccc2Cl)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 12002524 | 191782 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1F | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519811 | 191782 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)cc1F | 10.1016/j.bmcl.2009.03.014 | |||
| 136375437 | 178081 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 8 | 3 | 7 | 3.6 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccccc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647670 | 178081 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 432 | 8 | 3 | 7 | 3.6 | O=C(CCc1nc(-c2ccc(O)cc2)no1)Nc1cn(Cc2ccccc2)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 135899325 | 16193 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224147 | 16193 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 299 | 5 | 1 | 4 | 2.2 | O=c1[nH]c(COCCc2ccc(F)cc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899324 | 16191 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 327 | 7 | 1 | 6 | 2.2 | COc1ccc(OCCCOc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224145 | 16191 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 327 | 7 | 1 | 6 | 2.2 | COc1ccc(OCCCOc2nc3ncccc3c(=O)[nH]2)cc1 | 10.1016/j.bmcl.2010.07.108 | |||
| 135899178 | 16210 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224219 | 16210 | 0 | None | - | 0 | Rat | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 315 | 5 | 1 | 4 | 2.7 | O=c1[nH]c(COCCc2cccc(Cl)c2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 156010038 | 177030 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4632359 | 177030 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 414 | 8 | 3 | 4 | 5.1 | CCCCn1cc(NC(=O)CCc2ccc3c(Cl)c(O)ccc3c2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 16048768 | 94450 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(C(=O)Nc2ccccc2C(=O)O)[C@H](C)CN1c1cnc2ccccc2n1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL251222 | 94450 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 405 | 3 | 2 | 5 | 3.5 | C[C@H]1CN(C(=O)Nc2ccccc2C(=O)O)[C@H](C)CN1c1cnc2ccccc2n1 | 10.1016/j.bmcl.2007.10.055 | |||
| 137659759 | 159267 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 314 | 4 | 3 | 4 | 1.9 | O=C(CCC#Cc1ccc(O)cn1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4099278 | 159267 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 314 | 4 | 3 | 4 | 1.9 | O=C(CCC#Cc1ccc(O)cn1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 12003787 | 195842 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 296 | 2 | 2 | 2 | 2.8 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL558463 | 195842 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 296 | 2 | 2 | 2 | 2.8 | O=C(O)c1n[nH]c2c1CC(c1cc(F)cc(F)c1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 137639493 | 156911 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4072283 | 156911 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 315 | 4 | 2 | 2 | 3.0 | O=C(CCC#Cc1ccccc1F)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 135899321 | 16115 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 281 | 5 | 1 | 4 | 2.1 | O=c1[nH]c(COCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223878 | 16115 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 281 | 5 | 1 | 4 | 2.1 | O=c1[nH]c(COCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 16048843 | 154391 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 392 | 3 | 3 | 6 | 2.3 | Nc1ccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc2c1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL398762 | 154391 | 0 | None | - | 0 | Human | 5.2 | pIC50 | = | 5.2 | Binding | ChEMBL | 392 | 3 | 3 | 6 | 2.3 | Nc1ccc2nc(N3CCN(C(=O)Nc4ccccc4C(=O)O)CC3)cnc2c1 | 10.1016/j.bmcl.2007.10.055 | |||
| 11424509 | 188288 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 218 | 3 | 2 | 4 | 1.1 | CCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL500239 | 188288 | 0 | None | - | 0 | Human | 6.2 | pIC50 | = | 6.2 | Binding | ChEMBL | 218 | 3 | 2 | 4 | 1.1 | CCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 46890237 | 7099 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | Cc1c(CCC(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085148 | 7099 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 370 | 6 | 3 | 6 | 2.2 | Cc1c(CCC(=O)NC2=C(C(=O)O)CCCC2)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 135966934 | 6842 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 7 | 3 | 7 | 3.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084030 | 6842 | 0 | None | - | 0 | Human | 8.2 | pIC50 | = | 8.2 | Binding | ChEMBL | 452 | 7 | 3 | 7 | 3.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 46890298 | 7162 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085414 | 7162 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12002518 | 188879 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cc(F)cc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL507182 | 188879 | 0 | None | - | 0 | Human | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cc(F)cc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002518 | 188879 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cc(F)cc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL507182 | 188879 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cc(F)cc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Mouse | 7.2 | pIC50 | = | 7.2 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2010.06.041 | |||
| 156020512 | 178104 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 403 | 9 | 3 | 8 | 2.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCF)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4647933 | 178104 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 403 | 9 | 3 | 8 | 2.3 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1cn(CCCF)cc1C(=O)O | 10.1016/j.bmcl.2020.127105 | |||
| 11624691 | 7227 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL1085711 | 7227 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccc(O)cc2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 137641317 | 157011 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 383 | 6 | 2 | 2 | 5.0 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4073374 | 157011 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 383 | 6 | 2 | 2 | 5.0 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 137648386 | 157772 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 347 | 4 | 3 | 3 | 3.2 | O=C(CCC#Cc1ccc(O)cc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4082765 | 157772 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 347 | 4 | 3 | 3 | 3.2 | O=C(CCC#Cc1ccc(O)cc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 12002616 | 184181 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL483142 | 184181 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 16048995 | 94655 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 375 | 3 | 2 | 3 | 3.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL252505 | 94655 | 0 | None | - | 0 | Human | 4.1 | pIC50 | = | 4.1 | Binding | ChEMBL | 375 | 3 | 2 | 3 | 3.9 | O=C(O)c1ccccc1NC(=O)N1CCN(c2ccc3ccccc3c2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 11646494 | 121809 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 375 | 7 | 2 | 3 | 4.6 | COc1cccc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)c1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589783 | 121809 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 375 | 7 | 2 | 3 | 4.6 | COc1cccc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)c1 | 10.1016/j.bmc.2015.02.018 | |||
| 11516424 | 7315 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 379 | 6 | 3 | 5 | 3.4 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1086104 | 7315 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 379 | 6 | 3 | 5 | 3.4 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cc1 | 10.1016/j.bmcl.2010.04.013 | |||
| 12002521 | 184821 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL485194 | 184821 | 0 | None | - | 0 | Human | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 266 | 2 | 2 | 4 | 1.8 | Cc1ccccc1C1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 135401975 | 94748 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccc(O)cc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL253128 | 94748 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3ccc(O)cc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 11647028 | 88682 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 401 | 6 | 3 | 4 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL235954 | 88682 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 401 | 6 | 3 | 4 | 5.0 | O=C(CCc1ccc(-c2ccc(O)cc2Cl)s1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 11501698 | 192570 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 376 | 5 | 3 | 6 | 2.9 | O=C(CCc1nnn2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| CHEMBL521326 | 192570 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 376 | 5 | 3 | 6 | 2.9 | O=C(CCc1nnn2c1ccc1cc(O)ccc12)Nc1ccccc1C(=O)O | 10.1021/jm900151e | |||
| 136086829 | 7338 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 466 | 7 | 3 | 7 | 3.6 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cccc(F)c1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086225 | 7338 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 466 | 7 | 3 | 7 | 3.6 | C[C@H]1CC(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)=C(C(=O)O)C[C@H]1c1cccc(F)c1 | 10.1016/j.bmcl.2010.04.001 | |||
| 46890269 | 7374 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 381 | 7 | 3 | 3 | 4.5 | CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1086353 | 7374 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 381 | 7 | 3 | 3 | 4.5 | CCCC1CCC(NC(=O)CCc2ccc3cc(O)ccc3c2)=C(C(=O)O)C1 | 10.1016/j.bmcl.2010.04.001 | |||
| 15986755 | 184118 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL482698 | 184118 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 339 | 5 | 3 | 3 | 3.5 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 46890299 | 7215 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1085655 | 7215 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 433 | 6 | 3 | 3 | 5.0 | O=C(CCc1ccc2cc(O)ccc2c1)NC1=C(C(=O)O)CC(c2ccc(F)cc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 11736428 | 189063 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL509541 | 189063 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 232 | 4 | 2 | 4 | 1.5 | CCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12002618 | 191991 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL520137 | 191991 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 306 | 2 | 2 | 4 | 1.9 | Fc1cc(F)c(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2010.06.041 | |||
| 12002517 | 191882 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL519966 | 191882 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 270 | 2 | 2 | 4 | 1.6 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 12003597 | 14978 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1ccsc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208925 | 14978 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1ccsc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 11710202 | 121808 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 359 | 6 | 2 | 2 | 4.9 | Cc1cccc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)c1 | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589782 | 121808 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 359 | 6 | 2 | 2 | 4.9 | Cc1cccc(-c2ccc(CCC(=O)Nc3ccccc3C(=O)O)cc2)c1 | 10.1016/j.bmc.2015.02.018 | |||
| 16048840 | 94044 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 391 | 3 | 2 | 5 | 3.1 | O=C(O)c1ccccc1NC(=O)N1CCCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL248851 | 94044 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 391 | 3 | 2 | 5 | 3.1 | O=C(O)c1ccccc1NC(=O)N1CCCN(c2cnc3ccccc3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 44591601 | 184311 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 260 | 6 | 2 | 4 | 2.3 | CCCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL484172 | 184311 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 260 | 6 | 2 | 4 | 2.3 | CCCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 122181103 | 121814 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2ccccc2F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589788 | 121814 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 363 | 6 | 2 | 2 | 4.8 | O=C(CCc1ccc(-c2ccccc2F)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 135899300 | 16114 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 295 | 6 | 1 | 4 | 2.7 | O=c1[nH]c(OCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223877 | 16114 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 295 | 6 | 1 | 4 | 2.7 | O=c1[nH]c(OCCCCc2ccccc2)nc2ncccc12 | 10.1016/j.bmcl.2010.07.108 | |||
| 46890538 | 7039 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 7 | 3 | 7 | 2.7 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084840 | 7039 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 469 | 7 | 3 | 7 | 2.7 | NC(Cc1nc(-c2ccc(F)cn2)no1)C(=O)NC1=C(C(=O)O)CC(c2cccc(F)c2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12003791 | 194829 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237147 | 194829 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL539398 | 194829 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 261 | 2 | 2 | 3 | 1.9 | O=C(O)c1n[nH]c2c1CC(c1cccnc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 12002616 | 184181 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL483142 | 184181 | 0 | None | - | 0 | Mouse | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1ccc(F)c(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1 | 10.1016/j.bmcl.2009.03.014 | |||
| 11581300 | 121816 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccccc2O)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589790 | 121816 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2ccccc2O)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 135899150 | 16174 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1cccc(OCCCOc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1224074 | 16174 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 311 | 6 | 1 | 5 | 2.5 | Cc1cccc(OCCCOc2nc3ncccc3c(=O)[nH]2)c1 | 10.1016/j.bmcl.2010.07.108 | |||
| 11501164 | 187178 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 349 | 6 | 2 | 3 | 4.1 | COc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| CHEMBL492220 | 187178 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 349 | 6 | 2 | 3 | 4.1 | COc1ccc2cc(CCC(=O)Nc3ccccc3C(=O)O)ccc2c1 | 10.1016/j.bmcl.2008.08.030 | |||
| 135401974 | 154723 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3cccc(O)c3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| CHEMBL399859 | 154723 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 393 | 3 | 3 | 6 | 2.4 | O=C(O)c1ccccc1NC(=O)N1CCN(c2cnc3cccc(O)c3n2)CC1 | 10.1016/j.bmcl.2007.10.055 | |||
| 44591601 | 184311 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 260 | 6 | 2 | 4 | 2.3 | CCCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL484172 | 184311 | 0 | None | - | 0 | Human | 6.1 | pIC50 | = | 6.1 | Binding | ChEMBL | 260 | 6 | 2 | 4 | 2.3 | CCCCCCC1Cc2[nH]nc(-c3nnn[nH]3)c2C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 137653026 | 158707 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 329 | 3 | 2 | 2 | 3.3 | O=C(/C=C/C#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| CHEMBL4093294 | 158707 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 329 | 3 | 2 | 2 | 3.3 | O=C(/C=C/C#Cc1ccccc1Cl)NC1=C(C(=O)O)CCCC1 | 10.1016/j.bmc.2017.06.028 | |||
| 46890275 | 6530 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 412 | 8 | 3 | 6 | 3.2 | CCCC1CCC(C(=O)O)=C(NC(=O)C(C)Cc2ccn(-c3ccc(O)cn3)n2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1082823 | 6530 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 412 | 8 | 3 | 6 | 3.2 | CCCC1CCC(C(=O)O)=C(NC(=O)C(C)Cc2ccn(-c3ccc(O)cn3)n2)C1 | 10.1016/j.bmcl.2010.04.013 | |||
| 11617480 | 88681 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 362 | 6 | 3 | 4 | 3.7 | O=C(CCc1ccc(-c2ccc(O)cn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL235952 | 88681 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 362 | 6 | 3 | 4 | 3.7 | O=C(CCc1ccc(-c2ccc(O)cn2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 46890577 | 6672 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 490 | 7 | 2 | 6 | 4.0 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1083442 | 6672 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 490 | 7 | 2 | 6 | 4.0 | O=C(CCc1nc(-c2ccc(F)cn2)no1)NC1=C(C(=O)O)CC(c2cc(F)cc(F)c2F)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 136086824 | 6843 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 453 | 7 | 3 | 8 | 2.7 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| CHEMBL1084031 | 6843 | 0 | None | - | 0 | Human | 8.1 | pIC50 | = | 8.1 | Binding | ChEMBL | 453 | 7 | 3 | 8 | 2.7 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CC(c2ccc(F)nc2)CC1 | 10.1016/j.bmcl.2010.04.001 | |||
| 12003788 | 194941 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL1237148 | 194941 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| CHEMBL542000 | 194941 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 278 | 2 | 2 | 2 | 2.7 | O=C(O)c1n[nH]c2c1CC(c1cc(F)ccc1F)CC2 | 10.1016/j.bmcl.2009.06.054 | |||
| 12003597 | 14978 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1ccsc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208925 | 14978 | 0 | None | - | 0 | Human | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 234 | 2 | 2 | 3 | 2.1 | O=C(O)c1n[nH]c2c1CC(c1ccsc1)C2 | 10.1016/j.bmcl.2010.06.041 | |||
| 12002525 | 192343 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1F | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520676 | 192343 | 0 | None | - | 0 | Mouse | 7.1 | pIC50 | = | 7.1 | Binding | ChEMBL | 288 | 2 | 2 | 4 | 1.8 | Fc1cccc(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)c1F | 10.1016/j.bmcl.2009.03.014 | |||
| 11299550 | 192007 | 0 | None | - | 0 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 244 | 2 | 2 | 4 | 1.5 | C1CCC(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)C1 | 10.1016/j.bmcl.2009.03.014 | |||
| CHEMBL520159 | 192007 | 0 | None | - | 0 | Mouse | 5.1 | pIC50 | = | 5.1 | Binding | ChEMBL | 244 | 2 | 2 | 4 | 1.5 | C1CCC(C2Cc3[nH]nc(-c4nnn[nH]4)c3C2)C1 | 10.1016/j.bmcl.2009.03.014 | |||
| 122181107 | 121819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 4.5 | O=C(CCc1ccc(-c2ccc(O)c(F)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589793 | 121819 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 3 | 3 | 4.5 | O=C(CCc1ccc(-c2ccc(O)c(F)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 46890199 | 7158 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 380 | 6 | 3 | 6 | 2.8 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| CHEMBL1085401 | 7158 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 380 | 6 | 3 | 6 | 2.8 | Cc1c(CC(C)C(=O)Nc2ccccc2C(=O)O)cnn1-c1ccc(O)cn1 | 10.1016/j.bmcl.2010.04.013 | |||
| 135899280 | 16134 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 308 | 5 | 2 | 4 | 1.6 | O=C(CCc1ccccc1)NCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| CHEMBL1223958 | 16134 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 308 | 5 | 2 | 4 | 1.6 | O=C(CCc1ccccc1)NCc1nc2ncccc2c(=O)[nH]1 | 10.1016/j.bmcl.2010.07.108 | |||
| 11625092 | 6684 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL1083473 | 6684 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 379 | 6 | 2 | 2 | 5.3 | O=C(CCc1ccc(-c2ccccc2Cl)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 11617151 | 88639 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| CHEMBL235741 | 88639 | 0 | None | - | 0 | Human | 7.0 | pIC50 | = | 7.0 | Binding | ChEMBL | 345 | 6 | 2 | 2 | 4.6 | O=C(CCc1ccc(-c2ccccc2)cc1)Nc1ccccc1C(=O)O | 10.1021/jm700942d | |||
| 11631886 | 121812 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| CHEMBL3589786 | 121812 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 361 | 6 | 3 | 3 | 4.3 | O=C(CCc1ccc(-c2cccc(O)c2)cc1)Nc1ccccc1C(=O)O | 10.1016/j.bmc.2015.02.018 | |||
| 136375465 | 177133 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 357 | 6 | 3 | 8 | 1.4 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| CHEMBL4633857 | 177133 | 0 | None | - | 0 | Human | 6.0 | pIC50 | = | 6.0 | Binding | ChEMBL | 357 | 6 | 3 | 8 | 1.4 | Cn1cc(NC(=O)CCc2nc(-c3ccc(O)cn3)no2)c(C(=O)O)c1 | 10.1016/j.bmcl.2020.127105 | |||
| 49862073 | 14973 | 1 | None | - | 0 | Mouse | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 194 | 2 | 2 | 2 | 1.5 | CC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| CHEMBL1208920 | 14973 | 1 | None | - | 0 | Mouse | 6.0 | pIC50 | = | 6 | Binding | ChEMBL | 194 | 2 | 2 | 2 | 1.5 | CC(C)C1Cc2[nH]nc(C(=O)O)c2C1 | 10.1016/j.bmcl.2010.06.041 | |||
| 135887290 | 6987 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 430 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C(F)(F)C(F)(F)c2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1084657 | 6987 | 0 | None | - | 1 | Human | 8.9 | pKi | = | 8.9 | Binding | ChEMBL | 430 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C(F)(F)C(F)(F)c2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| 6436431 | 61701 | 4 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 158 | 4 | 1 | 3 | 0.6 | CCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771638 | 61701 | 4 | None | - | 1 | Human | 6.0 | pKi | = | 6 | Binding | ChEMBL | 158 | 4 | 1 | 3 | 0.6 | CCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 54580649 | 61747 | 2 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 220 | 5 | 1 | 3 | 1.4 | O=C(O)/C=C/C(=O)OCCc1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771739 | 61747 | 2 | None | - | 1 | Human | 5.0 | pKi | = | 5 | Binding | ChEMBL | 220 | 5 | 1 | 3 | 1.4 | O=C(O)/C=C/C(=O)OCCc1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.0 | pKi | = | 7.0 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 135887288 | 7616 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1088074 | 7616 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | |||
| 135887285 | 7438 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 384 | 6 | 3 | 7 | 2.2 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CC2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086658 | 7438 | 0 | None | - | 1 | Human | 8.0 | pKi | = | 8.0 | Binding | ChEMBL | 384 | 6 | 3 | 7 | 2.2 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CC2)CCCC1 | 10.1021/jm100022r | |||
| 135416391 | 6920 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| CHEMBL1084393 | 6920 | 0 | None | - | 1 | Human | 6.0 | pKi | = | 6.0 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | |||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | |||
| 11041813 | 93751 | 22 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 202 | 3 | 2 | 2 | 1.7 | O=C(O)c1cc(Cc2ccccc2)n[nH]1 | 10.1021/jm030888c | |||
| CHEMBL247317 | 93751 | 22 | None | - | 1 | Rat | 5.9 | pKi | = | 5.9 | Binding | ChEMBL | 202 | 3 | 2 | 2 | 1.7 | O=C(O)c1cc(Cc2ccccc2)n[nH]1 | 10.1021/jm030888c | |||
| 135887289 | 6921 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| CHEMBL1084394 | 6921 | 0 | None | - | 1 | Human | 6.9 | pKi | = | 6.9 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| 5787 | 3005 | 119 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 10.1016/j.bmcl.2010.11.091 | |||
| 637542 | 3005 | 119 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL66879 | 3005 | 119 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 10.1016/j.bmcl.2010.11.091 | |||
| DB04066 | 3005 | 119 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 164 | 2 | 2 | 2 | 1.5 | OC(=O)/C=C/c1ccc(cc1)O | 10.1016/j.bmcl.2010.11.091 | |||
| 643403 | 101592 | 79 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 138 | 2 | 1 | 2 | 1.4 | O=C(O)/C=C/c1ccoc1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL298683 | 101592 | 79 | None | - | 1 | Human | 4.9 | pKi | = | 4.9 | Binding | ChEMBL | 138 | 2 | 1 | 2 | 1.4 | O=C(O)/C=C/c1ccoc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 676464 | 89876 | 75 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1021/jm030888c | |||
| CHEMBL237788 | 89876 | 75 | None | - | 1 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 154 | 3 | 2 | 2 | 1.1 | CCCc1cc(C(=O)O)n[nH]1 | 10.1021/jm030888c | |||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 776416 | 18938 | 108 | None | 1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800896z | |||
| CHEMBL128604 | 18938 | 108 | None | 1 | 2 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm800896z | |||
| 776416 | 18938 | 108 | None | -1 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm030888c | |||
| CHEMBL128604 | 18938 | 108 | None | -1 | 2 | Rat | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 152 | 1 | 2 | 2 | 0.6 | O=C(O)c1n[nH]c2c1CCC2 | 10.1021/jm030888c | |||
| 11830866 | 19409 | 35 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 216 | 4 | 2 | 2 | 1.9 | O=C(O)c1cc(CCc2ccccc2)[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL129385 | 19409 | 35 | None | - | 1 | Rat | 5.8 | pKi | = | 5.8 | Binding | ChEMBL | 216 | 4 | 2 | 2 | 1.9 | O=C(O)c1cc(CCc2ccccc2)[nH]n1 | 10.1021/jm030888c | |||
| 5369209 | 2591 | 81 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 5786 | 2591 | 81 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL589586 | 2591 | 81 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| DB14219 | 2591 | 81 | None | - | 1 | Human | 6.8 | pKi | = | 6.8 | Binding | ChEMBL | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 10878560 | 19147 | 3 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 216 | 3 | 2 | 2 | 2.0 | Cc1ccc(Cc2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| CHEMBL128949 | 19147 | 3 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 216 | 3 | 2 | 2 | 2.0 | Cc1ccc(Cc2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| 13169286 | 18840 | 1 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 266 | 11 | 2 | 2 | 4.2 | CCCCCCCCCCCc1cc(C(=O)O)[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL128077 | 18840 | 1 | None | - | 1 | Rat | 4.7 | pKi | = | 4.7 | Binding | ChEMBL | 266 | 11 | 2 | 2 | 4.2 | CCCCCCCCCCCc1cc(C(=O)O)[nH]n1 | 10.1021/jm030888c | |||
| 135416393 | 7629 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1088213 | 7629 | 0 | None | - | 1 | Human | 7.7 | pKi | = | 7.7 | Binding | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 6.6 | pKi | = | 6.6 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 54582649 | 61750 | 1 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 224 | 4 | 1 | 3 | 1.5 | O=C(O)/C=C/C(=O)OCc1cccc(F)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771745 | 61750 | 1 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 224 | 4 | 1 | 3 | 1.5 | O=C(O)/C=C/C(=O)OCc1cccc(F)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| 135887289 | 6921 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| CHEMBL1084394 | 6921 | 0 | None | - | 1 | Human | 4.6 | pKi | = | 4.6 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.5 | CC(C)(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| 5816396 | 61705 | 6 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 200 | 7 | 1 | 3 | 1.8 | CCCCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771642 | 61705 | 6 | None | - | 1 | Human | 5.6 | pKi | = | 5.6 | Binding | ChEMBL | 200 | 7 | 1 | 3 | 1.8 | CCCCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 135416391 | 6920 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| CHEMBL1084393 | 6920 | 0 | None | - | 1 | Human | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.4 | CC(CC(=O)NC1=C(C(=O)O)CCCC1)c1nc(-c2ccc(O)cn2)no1 | 10.1021/jm100022r | |||
| 135416388 | 7524 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1087302 | 7524 | 0 | None | - | 1 | Human | 8.5 | pKi | = | 8.5 | Binding | ChEMBL | 358 | 6 | 3 | 7 | 1.8 | O=C(CCc1nc(-c2ccc(O)cn2)no1)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 117629482 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| 1588 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| 1594 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| 2835 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| 938 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| CHEMBL573 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| DB00627 | 2823 | 140 | None | 3 | 2 | Rat | 7.5 | pKi | = | 7.5 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm030888c | |||
| 648852 | 116910 | 91 | None | 1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 166 | 1 | 2 | 2 | 1.0 | O=C(O)c1n[nH]c2c1CCCC2 | 10.1021/jm800896z | |||
| CHEMBL338405 | 116910 | 91 | None | 1 | 2 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 166 | 1 | 2 | 2 | 1.0 | O=C(O)c1n[nH]c2c1CCCC2 | 10.1021/jm800896z | |||
| 6437229 | 61745 | 9 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 206 | 4 | 1 | 3 | 1.4 | O=C(O)/C=C/C(=O)OCc1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771737 | 61745 | 9 | None | - | 1 | Human | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 206 | 4 | 1 | 3 | 1.4 | O=C(O)/C=C/C(=O)OCc1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 648852 | 116910 | 91 | None | -1 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 166 | 1 | 2 | 2 | 1.0 | O=C(O)c1n[nH]c2c1CCCC2 | 10.1021/jm030888c | |||
| CHEMBL338405 | 116910 | 91 | None | -1 | 2 | Rat | 5.5 | pKi | = | 5.5 | Binding | ChEMBL | 166 | 1 | 2 | 2 | 1.0 | O=C(O)c1n[nH]c2c1CCCC2 | 10.1021/jm030888c | |||
| 135887288 | 7616 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1088074 | 7616 | 0 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 398 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CCC2)CCCC1 | 10.1021/jm100022r | |||
| 10857469 | 118557 | 4 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2ccc(Cl)cc2)[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL341520 | 118557 | 4 | None | - | 1 | Rat | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2ccc(Cl)cc2)[nH]n1 | 10.1021/jm030888c | |||
| 818267 | 118452 | 83 | None | - | 1 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 202 | 2 | 2 | 2 | 2.1 | Cc1ccc(-c2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| CHEMBL341154 | 118452 | 83 | None | - | 1 | Rat | 4.4 | pKi | = | 4.4 | Binding | ChEMBL | 202 | 2 | 2 | 2 | 2.1 | Cc1ccc(-c2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| 135416394 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 5788 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 73755154 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| CHEMBL1086657 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 135800194 | 89491 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | |||
| CHEMBL237248 | 89491 | 0 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | ChEMBL | 354 | 6 | 3 | 7 | 2.1 | O=C(CCc1nc(-c2ccc(O)cn2)no1)Nc1ccccc1C(=O)O | 10.1021/jm100022r | |||
| 5358902 | 61700 | 79 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 144 | 3 | 1 | 3 | 0.2 | CCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771637 | 61700 | 79 | None | - | 1 | Human | 6.4 | pKi | = | 6.4 | Binding | ChEMBL | 144 | 3 | 1 | 3 | 0.2 | CCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 6057891 | 61702 | 33 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 158 | 3 | 1 | 3 | 0.6 | CC(C)OC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771639 | 61702 | 33 | None | - | 1 | Human | 5.4 | pKi | = | 5.4 | Binding | ChEMBL | 158 | 3 | 1 | 3 | 0.6 | CC(C)OC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 3203 | 939 | 111 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 444539 | 939 | 111 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL27246 | 939 | 111 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 148 | 2 | 1 | 1 | 1.8 | OC(=O)/C=C/c1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.3 | pKi | = | 7.3 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm800258p | |||
| 11776293 | 149257 | 8 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1021/jm030888c | |||
| CHEMBL394441 | 149257 | 8 | None | - | 1 | Rat | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 236 | 3 | 2 | 2 | 2.4 | O=C(O)c1cc(Cc2cccc(Cl)c2)n[nH]1 | 10.1021/jm030888c | |||
| 11159621 | 2548 | 46 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | |||
| 5784 | 2548 | 46 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | |||
| CHEMBL456145 | 2548 | 46 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | |||
| DB05939 | 2548 | 46 | None | - | 1 | Human | 6.3 | pKi | = | 6.3 | Binding | ChEMBL | 176 | 1 | 2 | 4 | 0.1 | n1[nH]nc(n1)c1n[nH]c2c1CCC2 | 10.1021/jm800258p | |||
| 735981 | 61752 | 101 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 154 | 2 | 1 | 2 | 1.8 | O=C(O)/C=C/c1cccs1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771765 | 61752 | 101 | None | - | 1 | Human | 5.3 | pKi | = | 5.3 | Binding | ChEMBL | 154 | 2 | 1 | 2 | 1.8 | O=C(O)/C=C/c1cccs1 | 10.1016/j.bmcl.2010.11.091 | |||
| 14112183 | 61746 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 220 | 4 | 1 | 3 | 1.9 | CC(OC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771738 | 61746 | 0 | None | - | 1 | Human | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 220 | 4 | 1 | 3 | 1.9 | CC(OC(=O)/C=C/C(=O)O)c1ccccc1 | 10.1016/j.bmcl.2010.11.091 | |||
| 574310 | 18956 | 148 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 112 | 1 | 2 | 2 | 0.1 | O=C(O)c1cc[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL128679 | 18956 | 148 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 112 | 1 | 2 | 2 | 0.1 | O=C(O)c1cc[nH]n1 | 10.1021/jm030888c | |||
| 135416394 | 2560 | 52 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 5788 | 2560 | 52 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 73755154 | 2560 | 52 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| CHEMBL1086657 | 2560 | 52 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 10.1021/jm100022r | |||
| 11746440 | 19403 | 1 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 230 | 5 | 2 | 2 | 2.3 | O=C(O)c1cc(CCCc2ccccc2)[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL129326 | 19403 | 1 | None | - | 1 | Rat | 5.2 | pKi | = | 5.2 | Binding | ChEMBL | 230 | 5 | 2 | 2 | 2.3 | O=C(O)c1cc(CCCc2ccccc2)[nH]n1 | 10.1021/jm030888c | |||
| 4430637 | 116837 | 93 | None | - | 1 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 222 | 2 | 2 | 2 | 2.4 | O=C(O)c1cc(-c2cccc(Cl)c2)[nH]n1 | 10.1021/jm030888c | |||
| CHEMBL338017 | 116837 | 93 | None | - | 1 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 222 | 2 | 2 | 2 | 2.4 | O=C(O)c1cc(-c2cccc(Cl)c2)[nH]n1 | 10.1021/jm030888c | |||
| 135416393 | 7629 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1088213 | 7629 | 0 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 374 | 6 | 4 | 8 | 0.8 | O=C(O)C1=C(NC(=O)C(O)Cc2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| 10922388 | 18516 | 3 | None | - | 1 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 232 | 4 | 2 | 3 | 1.7 | COc1ccc(Cc2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| CHEMBL127387 | 18516 | 3 | None | - | 1 | Rat | 4.2 | pKi | = | 4.2 | Binding | ChEMBL | 232 | 4 | 2 | 3 | 1.7 | COc1ccc(Cc2cc(C(=O)O)[nH]n2)cc1 | 10.1021/jm030888c | |||
| 776421 | 89928 | 108 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1021/jm030888c | |||
| CHEMBL238002 | 89928 | 108 | None | - | 1 | Rat | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 154 | 2 | 2 | 2 | 1.2 | CC(C)c1cc(C(=O)O)n[nH]1 | 10.1021/jm030888c | |||
| 10103897 | 61704 | 3 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 186 | 6 | 1 | 3 | 1.4 | CCCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771641 | 61704 | 3 | None | - | 1 | Human | 6.2 | pKi | = | 6.2 | Binding | ChEMBL | 186 | 6 | 1 | 3 | 1.4 | CCCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 13153555 | 93863 | 27 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1021/jm800896z | |||
| CHEMBL247921 | 93863 | 27 | None | - | 1 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 182 | 5 | 2 | 2 | 1.8 | CCCCCc1cc(C(=O)O)[nH]n1 | 10.1021/jm800896z | |||
| 1591 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1021/jm030888c | |||
| 6485181 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1021/jm030888c | |||
| CHEMBL428730 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 10.1021/jm030888c | |||
| 5475335 | 61703 | 28 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 172 | 5 | 1 | 3 | 1.0 | CCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771640 | 61703 | 28 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 172 | 5 | 1 | 3 | 1.0 | CCCCOC(=O)/C=C/C(=O)O | 10.1016/j.bmcl.2010.11.091 | |||
| 135416392 | 7437 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086656 | 7437 | 0 | None | - | 1 | Human | 8.1 | pKi | = | 8.1 | Binding | ChEMBL | 372 | 6 | 3 | 7 | 2.0 | CC(Cc1nc(-c2ccc(O)cn2)no1)C(=O)NC1=C(C(=O)O)CCCC1 | 10.1021/jm100022r | |||
| 643402 | 61751 | 99 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 138 | 2 | 1 | 2 | 1.4 | O=C(O)/C=C/c1ccco1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771761 | 61751 | 99 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 138 | 2 | 1 | 2 | 1.4 | O=C(O)/C=C/c1ccco1 | 10.1016/j.bmcl.2010.11.091 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.1 | pKi | = | 7.1 | Binding | ChEMBL | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 10.1021/jm100022r | |||
| 135887290 | 6987 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 430 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C(F)(F)C(F)(F)c2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1084657 | 6987 | 0 | None | - | 1 | Human | 6.1 | pKi | = | 6.1 | Binding | ChEMBL | 430 | 6 | 3 | 7 | 2.6 | O=C(O)C1=C(NC(=O)C(F)(F)C(F)(F)c2nc(-c3ccc(O)cn3)no2)CCCC1 | 10.1021/jm100022r | |||
| 54583606 | 61749 | 1 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 240 | 4 | 1 | 3 | 2.0 | O=C(O)/C=C/C(=O)OCc1cccc(Cl)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771744 | 61749 | 1 | None | - | 1 | Human | 5.1 | pKi | = | 5.1 | Binding | ChEMBL | 240 | 4 | 1 | 3 | 2.0 | O=C(O)/C=C/C(=O)OCc1cccc(Cl)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| 135887285 | 7438 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 384 | 6 | 3 | 7 | 2.2 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CC2)CCCC1 | 10.1021/jm100022r | |||
| CHEMBL1086658 | 7438 | 0 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 384 | 6 | 3 | 7 | 2.2 | O=C(O)C1=C(NC(=O)C2(Cc3nc(-c4ccc(O)cn4)no3)CC2)CCCC1 | 10.1021/jm100022r | |||
| 54582648 | 61748 | 1 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 284 | 4 | 1 | 3 | 2.1 | O=C(O)/C=C/C(=O)OCc1cccc(Br)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| CHEMBL1771743 | 61748 | 1 | None | - | 1 | Human | 5.0 | pKi | = | 5.0 | Binding | ChEMBL | 284 | 4 | 1 | 3 | 2.1 | O=C(O)/C=C/C(=O)OCc1cccc(Br)c1 | 10.1016/j.bmcl.2010.11.091 | |||
| 117629482 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1588 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1594 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 2835 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 938 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| CHEMBL573 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| DB00627 | 2823 | 140 | None | - | 2 | Mouse | 8.2 | pIC50 | = | 8.2 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12522134 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12563315 | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 7.2 | pKd | = | 7.2 | Binding | Guide to Pharmacology | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | 12646212 | |||
| 637568 | 217740 | 0 | None | - | 1 | Human | 8.2 | pKi | = | 8.2 | Binding | Drug Central | 144 | 2 | 0 | 4 | -0.1 | COC(=O)\C=C\C(=O)OC | None | |||
| 117629482 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1588 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1594 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 2835 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 938 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| CHEMBL573 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| DB00627 | 2823 | 140 | None | -3 | 2 | Human | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 117629482 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1588 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 1594 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 2835 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 938 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| CHEMBL573 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| DB00627 | 2823 | 140 | None | 3 | 2 | Rat | 8.1 | pKi | = | 8.1 | Binding | Drug Central | 123 | 1 | 1 | 2 | 0.8 | OC(=O)c1cccnc1 | None | |||
| 5369209 | 2591 | 81 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 21167710 | |||
| 5786 | 2591 | 81 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 21167710 | |||
| CHEMBL589586 | 2591 | 81 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 21167710 | |||
| DB14219 | 2591 | 81 | None | - | 1 | Human | 6.7 | pKi | = | 6.7 | Binding | Guide to Pharmacology | 130 | 2 | 1 | 3 | -0.2 | COC(=O)/C=C/C(=O)O | 21167710 | |||
| 135416394 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | |||
| 5788 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | |||
| 73755154 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | |||
| CHEMBL1086657 | 2560 | 52 | None | - | 1 | Human | 8.4 | pKi | = | 8.4 | Binding | Guide to Pharmacology | 386 | 6 | 3 | 7 | 2.4 | Oc1ccc(nc1)c1noc(n1)CC(C(=O)NC1=C(CCCC1)C(=O)O)(C)C | 20184326 | |||
| 1591 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 12930155 | |||
| 6485181 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 12930155 | |||
| CHEMBL428730 | 131 | 63 | None | - | 1 | Rat | 7.1 | pKi | None | 7.1 | Binding | Guide to Pharmacology | 168 | 4 | 2 | 2 | 1.5 | CCCCc1cc(n[nH]1)C(=O)O | 12930155 | |||