Molecule Details
| InChIKey | LQOLIRLGBULYKD-JKIFEVAISA-N |
|---|---|
| Compound Name | Cloxacillin |
| Canonical SMILES | Cc1onc(-c2ccccc2Cl)c1C(=O)N[C@@H]1C(=O)N2[C@@H]1SC(C)(C)[C@@H]2C(=O)O |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 3 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 8.13 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB01147 |
|---|---|
| Drug Name | Cloxacillin |
| CAS Number | 61-72-3 |
| Groups | approved investigational vet_approved |
| ATC Codes | J01CR50 J01CF02 |
| Description | A semi-synthetic penicillin antibiotic which is a chlorinated derivative of [oxacillin]. |
Categories: Amides Anti-Bacterial Agents Anti-Infective Agents Antibacterials for Systemic Use Antiinfectives for Systemic Use Beta-Lactam Antibacterials Beta-Lactamase Resistant Penicillins Heterocyclic Compounds, Fused-Ring Lactams OAT3/SLC22A8 Inhibitors OAT3/SLC22A8 Substrates Penicillinase-resistant Penicillins Penicillins Sulfur Compounds beta-Lactams
Cross-references: BindingDB: 50022788 ChEBI: 49566 CHEMBL891 ChemSpider: 5873 Drugs Product Database (DPD): 8411 C06923 PDB: CXN PharmGKB: PA449059 PubChem:6098 PubChem:46507109 RxCUI: 2625 Therapeutic Targets Database: DAP001161 Wikipedia: Cloxacillin ZINC: ZINC000003875417
Target Activities (3)
DrugBank Target Actions (8)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P02768 | ALB | Albumin | binder | carriers |
| P0AEB2 | P0AEB2 | D-alanyl-D-alanine carboxypeptidase DacA | inhibitor | targets |
| P59676 | P59676 | Penicillin-binding protein 2X | inhibitor | targets |
| Q8DR59 | Q8DR59 | Penicillin-binding protein 1A | inhibitor | targets |
| P46059 | SLC15A1 | Solute carrier family 15 member 1 | inhibitor | transporters |
| Q16348 | Q16348 | Solute carrier family 15 member 2 | inhibitor | transporters |
| Q8TCC7 | SLC22A8 | Organic anion transporter 3 | inhibitor | transporters |
| Q8TCC7 | SLC22A8 | Organic anion transporter 3 | substrate | transporters |