SOMATOSTATIN


SMILES C[C@H](N)C(=O)NCC(=O)N[C@H]1CSSC[C@@H](C(=O)O)NC(=O)[C@H](CO)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H]([C@@H](C)O)NC(=O)[C@H](CCCCN)NC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](Cc2ccccc2)NC(=O)[C@H](CC(N)=O)NC(=O)[C@H](CCCCN)NC1=O
InChIKey NHXLMOGPVYXJNR-ATOGVRKGSA-N

Chemical properties

Hydrogen bond acceptors None
Hydrogen bond donors None
Rotatable bonds None
Molecular weight (Da)

Drug properties

Molecular type Protein
Physiological/Surrogate Surrogate
Approved drug No

Database connections

Structure pdb 7WJ5 7T10 7WIC 7Y27 7XMR 7XMS 7XAT

Bioactivities

Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST1 SSR1 Human Somatostatin A pKi 8.64 9.27 9.54 ChEMBL
SST4 SSR4 Human Somatostatin A pKi 8.75 8.98 9.23 ChEMBL
SST5 SSR5 Human Somatostatin A pKi 6.92 9.12 9.85 ChEMBL
SST2 SSR2 Human Somatostatin A pKi 9.64 10.04 10.46 ChEMBL
SST3 SSR3 Human Somatostatin A pKi 8.93 9.47 10.0 ChEMBL
Receptor Activity Source
GTP Uniprot Species Family Class Type Min Avg Max Database
SST2 SSR2 Mouse Somatostatin A pIC50 9.55 9.55 9.55 ChEMBL
SST3 SSR3 Mouse Somatostatin A pIC50 10.1 10.1 10.1 ChEMBL
SST1 SSR1 Human Somatostatin A pIC50 8.72 9.02 9.85 ChEMBL
SST4 SSR4 Human Somatostatin A pIC50 8.75 9.04 10.1 ChEMBL
SST5 SSR5 Human Somatostatin A pIC50 8.0 8.7 9.7 ChEMBL
SST5 SSR5 Human Somatostatin A pEC50 9.72 9.96 10.19 ChEMBL
SST2 SSR2 Human Somatostatin A pIC50 9.15 9.22 9.4 ChEMBL
SST2 SSR2 Human Somatostatin A pEC50 10.0 10.0 10.0 ChEMBL
SST3 SSR3 Human Somatostatin A pIC50 8.48 8.72 9.4 ChEMBL
SST3 SSR3 Human Somatostatin A pEC50 9.11 9.11 9.11 ChEMBL
μ OPRM Rat Opioid A pIC50 8.22 8.22 8.22 ChEMBL