GproteinDb

atrasentan

Agent/drug
Bioactivity

atrasentan

SMILES	CCCCN(CCCC)C(=O)CN1C[C@H](c2ccc3c(c2)OCO3)[C@@H](C(=O)O)[C@@H]1c1ccc(OC)cc1
InChIKey	MOTJMGVDPWRKOC-QPVYNBJUSA-N

Chemical Properties

Hydrogen bond acceptors	6
Hydrogen bond donors	1
Rotatable bonds	12
Molecular weight (Da)	510.3

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank PubChem GPCRdb

Bioactivities

Affinity
Potency

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

ET_A	EDNRA	Human	Endothelin	A	pKi	10.47	10.47	10.47	Guide to Pharmacology
ET_A	EDNRA	Human	Endothelin	A	pKi	10.47	10.47	10.47	ChEMBL
ET_A	EDNRA	Rat	Endothelin	A	pKi	10.33	10.40	10.47	ChEMBL
ET_B	EDNRB	Human	Endothelin	A	pKi	6.86	6.86	6.86	Guide to Pharmacology

Showing 1 to 4 of 4 entries

Search:

Receptor					Activity				Source

Protein	Gene	Species	Family	Class	Type	Min	Avg	Max	Database

ET_A	EDNRA	Human	Endothelin	A	pA2	9.20	9.20	9.20	Guide to Pharmacology
ET_A	EDNRA	Human	Endothelin	A	pIC50	9.51	10.16	10.47	ChEMBL
ET_A	EDNRA	Rat	Endothelin	A	pIC50	8.82	9.46	10.10	ChEMBL
ET_B	EDNRB	Human	Endothelin	A	pIC50	6.29	6.85	7.20	ChEMBL
ET_B	EDNRB	Pig	Endothelin	A	pIC50	6.28	6.65	6.96	ChEMBL

Showing 1 to 5 of 5 entries

atrasentan

Drug properties

Molecular type	Small molecule
Physiological/Surrogate	Surrogate
Approved drug	Yes

Clinical Trials

Phase I 1

Phase II 4

Phase III 4

Approved No

Database connections

PubChem Guide To Pharmacology ChEMBL_compound_ids DrugBank PubChem GPCRdb

Sankey plot

Drug Information

Search:

Target					Disease				Phase

Gene	Protein	Receptor family	Ligand type	Class	Indication name	ICD11	ATC	Association score	Phase	Approved

EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Adenocarcinoma of prostate	2C82.0		0.294	3	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Chronic kidney disease, stage unspecified	GB61.Z		0.227	3	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Malignant neoplasms of fallopian tube, unspecified	2C74.Z		0.092	2	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Malignant neoplasms of kidney, except renal pelvis, unspecified	2C90.Z		0.092	2	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Malignant neoplasms of ovary, unspecified	2C73.Z		0.282	2	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Malignant neoplasms of peritoneum, unspecified	2C51.Z		0.092	2	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Malignant neoplasms of prostate, unspecified	2C82.Z		0.199	3	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Nephritic syndrome	GB40		0.475	3	No
EDNRA	ET_A receptor	Endothelin receptors	Peptide receptors	Class A	Other and unspecified neoplasms of brain or central nervous system	2A0Z		0.046	1	No

Showing 1 to 9 of 9 entries