Molecule Details
| InChIKey | XUBOMFCQGDBHNK-UHFFFAOYSA-N |
|---|---|
| Canonical SMILES | COc1c(N2CCNC(C)C2)c(F)cc2c(=O)c(C(=O)O)cn(C3CC3)c12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Cross-Family |
| Avg pChEMBL | 6.3 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB01044 |
|---|---|
| Drug Name | Gatifloxacin |
| CAS Number | 112811-59-3 |
| Groups | approved investigational withdrawn |
| ATC Codes | S01AE06 J01MA16 |
| Description | Gatifloxacin is an antibiotic agent and a member of the fourth-generation fluoroquinolone family. It works by inhibiting the bacterial enzymes DNA gyrase and topoisomerase IV. It was first introduced by Bristol-Myers Squibb in 1999 under the brand name Tequin® for the treatment of respiratory tract ... |
Categories: 4-Quinolones Anti-Bacterial Agents Anti-Infective Agents Antibacterials for Systemic Use Antiinfectives for Systemic Use Compounds used in a research, industrial, or household setting Cytochrome P-450 CYP1A2 Inhibitors Cytochrome P-450 CYP1A2 Inhibitors (moderate) Cytochrome P-450 Enzyme Inhibitors Enzyme Inhibitors Fluoroquinolones Heterocyclic Compounds, Fused-Ring Hypoglycemia-Associated Agents Ophthalmic Solutions Ophthalmologicals Pharmaceutical Preparations Pharmaceutical Solutions Potential QTc-Prolonging Agents QTc Prolonging Agents Quinolines Quinolone Antimicrobial Quinolones Sensory Organs Solutions Topoisomerase II Inhibitors Topoisomerase Inhibitors
Cross-references: BindingDB: 50117914 ChEBI: 5280 CHEMBL31 ChemSpider: 5186 Drugs Product Database (DPD): 12056 C07661 D08011 PharmGKB: PA449738 PubChem:5379 PubChem:46506159 RxCUI: 1546025 Therapeutic Targets Database: DAP001387 Wikipedia: Gatifloxacin
Target Activities (2)
DrugBank Target Actions (8)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P02768 | ALB | Albumin | other/unknown | carriers |
| P05177 | CYP1A2 | Cytochrome P450 1A2 | inhibitor | enzymes |
| P0A0K8 | gyrB | DNA gyrase subunit B | inhibitor | targets |
| P0A4L9 | gyrB | DNA gyrase subunit B | inhibitor | targets |
| P20831 | gyrA | DNA gyrase subunit A | inhibitor | targets |
| P72524 | P72524 | DNA gyrase subunit A | inhibitor | targets |
| P72525 | P72525 | DNA topoisomerase 4 subunit A | inhibitor | targets |
| Q59961 | Q59961 | DNA topoisomerase 4 subunit B | inhibitor | targets |