ArrestinDb

adenosine

Agent/drug
Bioactivity

adenosine

SMILES	Nc1ncnc2c1ncn2[C@@H]1O[C@H](CO)[C@@H](O)[C@H]1O
InChIKey	OIRDTQYFTABQOQ-KQYNXXCUSA-N

Chemical Properties

Hydrogen bond acceptors	9
Hydrogen bond donors	4
Rotatable bonds	2
Molecular weight (Da)	267.1

Database connections

Guide To Pharmacology DrugBank Drug Central ChEMBL_compound_ids PubChem GPCRdb
Structure pdb	2YDO 6D9H 8HDP 7LD3 7LD4
Ligand site mutations	A₁ A_2A A_2B A₃

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A₁	AA1R	Human	Adenosine	A	pKi	7.00	7.00	7.00	Guide to Pharmacology
A₁	AA1R	Rat	Adenosine	A	pKi	7.14	7.14	7.14	Guide to Pharmacology
A₁	AA1R	Rat	Adenosine	A	pKi	4.54	7.24	8.29	ChEMBL
A₁	AA1R	Rat	Adenosine	A	pKd	5.71	5.71	5.71	ChEMBL
A₁	AA1R	Human	Adenosine	A	pKd	6.53	6.53	6.53	ChEMBL
A₁	AA1R	Human	Adenosine	A	pKi	6.09	6.09	6.09	ChEMBL
A₁	AA1R	Rat	Adenosine	A	pKi	8.08	8.08	8.08	Drug Central
A_2A	AA2AR	Human	Adenosine	A	pKi	6.51	6.51	6.51	Guide to Pharmacology
A_2A	AA2AR	Rat	Adenosine	A	pKi	6.82	6.82	6.82	Guide to Pharmacology
A_2A	AA2AR	Human	Adenosine	A	pKi	6.16	6.89	7.70	ChEMBL
A_2A	AA2AR	Human	Adenosine	A	pKd	7.76	7.76	7.76	ChEMBL
A_2A	AA2AR	Rat	Adenosine	A	pKi	8.12	8.12	8.12	Drug Central
A_2A	AA2AR	Rat	Adenosine	A	pKi	7.52	7.52	7.52	ChEMBL
A_2B	AA2BR	Rat	Adenosine	A	pKi	5.29	5.29	5.29	Guide to Pharmacology
A_2B	AA2BR	Human	Adenosine	A	pKi	4.82	4.82	4.82	Guide to Pharmacology
A₃	AA3R	Human	Adenosine	A	pKi	6.54	6.54	6.54	Guide to Pharmacology
A₃	AA3R	Rat	Adenosine	A	pKi	5.19	5.19	5.19	Guide to Pharmacology
A₃	AA3R	Rat	Adenosine	A	pKi	7.00	7.00	7.00	ChEMBL
A₃	AA3R	Human	Adenosine	A	pKi	8.18	8.18	8.18	Drug Central
A₃	AA3R	Rat	Adenosine	A	pKi	8.15	8.15	8.15	Drug Central

Showing 1 to 20 of 22 entries

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Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

A₁	AA1R	Guinea pig	Adenosine	A	pEC50	5.47	5.47	5.47	ChEMBL
A₁	AA1R	Human	Adenosine	A	pEC50	5.60	6.51	7.41	ChEMBL
A₁	AA1R	Human	Adenosine	A	pIC50	8.63	8.63	8.63	ChEMBL
A₁	AA1R	Human	Adenosine	A	pEC50	8.19	8.19	8.19	Drug Central
A_2A	AA2AR	Human	Adenosine	A	pEC50	8.21	8.21	8.21	Drug Central
A_2A	AA2AR	Human	Adenosine	A	pEC50	4.40	5.98	7.60	ChEMBL
A_2B	AA2BR	Human	Adenosine	A	pEC50	8.34	8.34	8.34	Drug Central
A_2B	AA2BR	Human	Adenosine	A	pEC50	4.29	4.95	7.28	ChEMBL
A₃	AA3R	Human	Adenosine	A	pEC50	5.98	6.67	7.87	ChEMBL
A₃	AA3R	Human	Adenosine	A	pIC50	8.94	8.94	8.94	ChEMBL

Showing 1 to 10 of 10 entries

adenosine

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Endogenous
Approved drug	Yes

Distribution across phases (no. indications)

Phase I 4

Phase II 16

Phase III 25

Phase IV 12

Database connections

Guide To Pharmacology DrugBank Drug Central ChEMBL_compound_ids PubChem GPCRdb
Structure pdb	2YDO 6D9H 8HDP 7LD3 7LD4
Ligand site mutations	A₁ A_2A A_2B A₃

Sankey plot

Drug Information

Search:

Target					Disease

Gene	Protein	Receptor family	Ligand type	Class	Name	Phase	ICD11	ATC	Association score

AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Acute ST elevation myocardial infarction	2	BA41.0	C01E	0.092
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Acute myocardial infarction, unspecified	3	BA41.Z	C01E	0.168
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Acute respiratory distress syndrome	2	CB00	C01E	0.038
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Angina pectoris, unspecified	3	BA40.Z	C01E	0.284
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Cardiomyopathy, unspecified	2	BC43.Z	C01E	0.074
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Chronic lymphocytic leukaemia of B-cell type	1	2A82.00	C01E	0.037
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Diseases of coronary artery, unspecified	3	BA8Z	C01E	0.447
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Diseases of the circulatory system, unspecified	4	BE2Z	C01E	0.372
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Other specified atherosclerotic chronic arterial occlusive disease	3	BD40.Y	C01E	0.037
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Pain, unspecified	3	MG3Z	C01E	0.575
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Paroxysmal tachycardia	4	MC81.3	C01E	0.587
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Stress-induced cardiomyopathy	2	BC43.5	C01E	0.388
AA1R	A₁ receptor	Adenosine receptors	Nucleotide receptors	A	Wolff-Parkinson-White syndrome	4	BC81.4	C01E	0.565
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Acute ST elevation myocardial infarction	2	BA41.0	C01E	0.092
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Acute myocardial infarction, unspecified	3	BA41.Z	C01E	0.178
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Acute respiratory distress syndrome	2	CB00	C01E	0.074
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Angina pectoris, unspecified	3	BA40.Z	C01E	0.268
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Cardiomyopathy, unspecified	2	BC43.Z	C01E	0.075
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Chronic lymphocytic leukaemia of B-cell type	1	2A82.00	C01E	0.040
AA2AR	A_2A receptor	Adenosine receptors	Nucleotide receptors	A	Diseases of coronary artery, unspecified	3	BA8Z	C01E	0.512

Showing 1 to 20 of 52 entries

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adenosine

adenosine

Chemical Properties

Database connections

Bioactivities

adenosine

Drug properties

Distribution across phases (no. indications)

Database connections

Sankey plot

Drug Information