Molecule Details
| InChIKey | KHPKQFYUPIUARC-UHFFFAOYSA-N |
|---|---|
| Compound Name | Lumiracoxib |
| Canonical SMILES | Cc1ccc(Nc2c(F)cccc2Cl)c(CC(=O)O)c1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.52 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB01283 |
|---|---|
| Drug Name | Lumiracoxib |
| CAS Number | 220991-20-8 |
| Groups | approved withdrawn |
| ATC Codes | M01AH06 |
| Description | Lumiracoxib is a COX-2 selective non-steroidal anti-inflammatory drug (NSAID). On August 11, 2007, Australia's Therapeutic Goods Administration (TGA, the Australian equivalent of the FDA) cancelled the registration of lumiracoxib in Australia due to concerns that it may cause liver failure. New Zeal... |
Categories: Acids, Carbocyclic Agents causing hyperkalemia Agents that produce hypertension Analgesics Analgesics, Non-Narcotic Anti-Inflammatory Agents Anti-Inflammatory Agents, Non-Steroidal Antiinflammatory and Antirheumatic Products Antiinflammatory and Antirheumatic Products, Non-Steroids Antirheumatic Agents COX-2 Inhibitors Cyclooxygenase Inhibitors Cytochrome P-450 CYP1A2 Substrates Cytochrome P-450 CYP2C19 Substrates Cytochrome P-450 CYP2C9 Substrates Cytochrome P-450 Substrates Enzyme Inhibitors Musculo-Skeletal System Nephrotoxic agents Peripheral Nervous System Agents Phenylacetates Selective Cyclooxygenase 2 Inhibitors (NSAIDs) Sensory System Agents UGT1A9 Substrates
Cross-references: BindingDB: 50207446 ChEBI: 73044 CHEMBL404108 ChemSpider: 133236 D03714 PDB: LUR PharmGKB: PA164769031 PubChem:151166 PubChem:46506378 Therapeutic Targets Database: DAP000970 Wikipedia: Lumiracoxib ZINC: ZINC000000007563
Target Activities (2)
DrugBank Target Actions (6)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| O60656 | O60656 | UDP-glucuronosyltransferase 1A9 | substrate | enzymes |
| P05177 | CYP1A2 | Cytochrome P450 1A2 | substrate | enzymes |
| P11712 | CYP2C9 | Cytochrome P450 2C9 | substrate | enzymes |
| P33261 | CYP2C19 | Cytochrome P450 2C19 | substrate | enzymes |
| P23219 | PTGS1 | Prostaglandin G/H synthase 1 | inhibitor | targets |
| P35354 | PTGS2 | Prostaglandin G/H synthase 2 | inhibitor | targets |