InChIKey	GJPICJJJRGTNOD-UHFFFAOYSA-N
Compound Name	Bosentan
Canonical SMILES	COc1ccccc1Oc1c(NS(=O)(=O)c2ccc(C(C)(C)C)cc2)nc(-c2ncccn2)nc1OCCO
Clinical Status	Data-mined Candidate
Targets (Human+Pathogen)	2
Pfam Stratification	Homologous
Avg pChEMBL	7.05
Source	ChEMBL;BindingDB

DrugBank ID	DB00559
Drug Name	Bosentan
CAS Number	147536-97-8
Groups	approved investigational
ATC Codes	G01AE10 C02KX01
Description	Bosentan is a dual endothelin receptor antagonist marketed under the trade name Tracleer by Actelion Pharmaceuticals. Bosentan is used to treat pulmonary hypertension by blocking the action of endothelin molecules that would otherwise promote narrowing of the blood vessels and lead to high blood pre...

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Categories: Amides Antihypertensive Agents Antihypertensives for Pulmonary Arterial Hypertension BSEP/ABCB11 Inhibitors Benzene Derivatives Benzenesulfonamides Cardiovascular Agents Cytochrome P-450 CYP2C9 Inducers Cytochrome P-450 CYP2C9 Inducers (moderate) Cytochrome P-450 CYP2C9 Substrates Cytochrome P-450 CYP3A Inducers Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Inducers Cytochrome P-450 CYP3A4 Inducers (moderate) Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Enzyme Inducers Cytochrome P-450 Substrates Endothelin Receptor Antagonists Genito Urinary System and Sex Hormones Gynecological Antiinfectives and Antiseptics Hepatotoxic Agents OATP1B1/SLCO1B1 Substrates Pyrimidines Sulfonamides Sulfones Sulfur Compounds Vasodilating Agents

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Cross-references: BindingDB: 50061101 ChEBI: 51450 CHEMBL957 ChemSpider: 94651 Drugs Product Database (DPD): 12538 D01227 PDB: K86 PharmGKB: PA10034 PubChem:104865 PubChem:46507154 RxCUI: 75207 Therapeutic Targets Database: DNC000341 Wikipedia: Bosentan ZINC: ZINC000001538857