Molecule Details
| InChIKey | UPSPUYADGBWSHF-UHFFFAOYSA-N |
|---|---|
| Compound Name | Tolmetin |
| Canonical SMILES | Cc1ccc(C(=O)c2ccc(CC(=O)O)n2C)cc1 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.53 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB00500 |
|---|---|
| Drug Name | Tolmetin |
| CAS Number | 26171-23-3 |
| Groups | approved |
| ATC Codes | M01AB03 M02AA21 |
| Description | A non-steroidal anti-inflammatory agent (anti-inflammatory agents, NON-steroidal) similar in mode of action to indomethacin. |
Categories: Acetic Acid Derivatives and Related Substances Agents causing hyperkalemia Agents that produce hypertension Analgesics Analgesics, Non-Narcotic Anti-Inflammatory Agents Anti-Inflammatory Agents, Non-Steroidal Anti-Inflammatory Agents, Non-Steroidal (Non-Selective) Antiinflammatory Preparations, Non-Steroids for Topical Use Antiinflammatory and Antirheumatic Products Antiinflammatory and Antirheumatic Products, Non-Steroids Antirheumatic Agents Cyclooxygenase Inhibitors Enzyme Inhibitors Musculo-Skeletal System Nephrotoxic agents Non COX-2 selective NSAIDS OAT1/SLC22A6 inhibitors Peripheral Nervous System Agents Sensory System Agents Topical Products for Joint and Muscular Pain
Cross-references: BindingDB: 50295287 ChEBI: 71941 CHEMBL1020 ChemSpider: 5308 Drugs Product Database (DPD): 11239 C07149 PDB: TLT PharmGKB: PA451721 PubChem:5509 PubChem:46507060 RxCUI: 10636 Therapeutic Targets Database: DAP000777 Wikipedia: Tolmetin ZINC: ZINC000000002191
Target Activities (3)
DrugBank Target Actions (6)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P02768 | ALB | Albumin | binder | carriers |
| P05164 | MPO | Myeloperoxidase | inhibitor | enzymes |
| P48775 | TDO2 | Tryptophan 2,3-dioxygenase | inhibitor | enzymes |
| P23219 | PTGS1 | Prostaglandin G/H synthase 1 | inhibitor | targets |
| P35354 | PTGS2 | Prostaglandin G/H synthase 2 | inhibitor | targets |
| Q4U2R8 | SLC22A6 | Solute carrier family 22 member 6 | inhibitor | transporters |