Molecule Details
| InChIKey | JZCPYUJPEARBJL-UHFFFAOYSA-N |
|---|---|
| Compound Name | Rimonabant |
| Canonical SMILES | Cc1c(C(=O)NN2CCCCC2)nn(-c2ccc(Cl)cc2Cl)c1-c1ccc(Cl)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 6 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 7.47 |
| Source | BindingDB;ChEMBL |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB06155 |
|---|---|
| Drug Name | Rimonabant |
| CAS Number | 168273-06-1 |
| Groups | approved withdrawn |
| ATC Codes | A08AX01 |
| Description | Rimonabant is an anorectic anti-obesity drug produced and marketed by Sanofi-Aventis. It is an inverse agonist for the cannabinoid receptor CB1. Its main avenue of effect is reduction in appetite. Rimonabant is the first selective CB1 receptor blocker to be approved for use anywhere in the world. Ri... |
Categories: Agents producing tachycardia Alimentary Tract and Metabolism Anti-Obesity Agents Antiobesity Preparations, Excl. Diet Products Cannabinoid Receptor Antagonists Cannabinoids and similars Cytochrome P-450 CYP3A Substrates Cytochrome P-450 CYP3A4 Substrates Cytochrome P-450 Substrates Hormones Hormones, Hormone Substitutes, and Hormone Antagonists Neurotransmitter Agents Piperidines Pyrazoles Receptor, Cannabinoid, CB1, antagonists & inhibitors
Cross-references: BindingDB: 21278 ChEBI: 34967 CHEMBL111 ChemSpider: 94641 Guide to Pharmacology: 745 IUPHAR: 745 C14319 D05731 PDB: AY6 PharmGKB: PA152407999 PubChem:104850 PubChem:99443236 Therapeutic Targets Database: DNC001371 Wikipedia: Rimonabant ZINC: ZINC000001540228
Target Activities (6)
| Target | Gene | Organism | Category | Pfam | pChEMBL | Type | Source |
|---|---|---|---|---|---|---|---|
| P11712 | CYP2C9 | Homo sapiens | Human | PF00067 | 8.3 | IC50 | ChEMBL;BindingDB |
| P21554 | CNR1 | Homo sapiens | Human | PF00001 | 8.2 | Ki | ChEMBL;BindingDB |
| P34972 | CNR2 | Homo sapiens | Human | PF00001 | 6.2 | Ki | ChEMBL;BindingDB |
| P32835 | GSP1 | Saccharomyces cerevisiae (strain ATCC 204508 / S288c) | Pathogen | PF00071 | 8.7 | Ki | BindingDB |
| A0A0V1DID4 | CNRIP1 | Trichinella britovi | Pathogen | PF15043 | 7.5 | Ki | BindingDB |
| P32836 | GSP2 | Saccharomyces cerevisiae (strain ATCC 204508 / S288c) | Pathogen | PF00071 | 6.0 | Ki | BindingDB |