Molecule Details
| InChIKey | OUGIDAPQYNCXRA-UHFFFAOYSA-N |
|---|---|
| Canonical SMILES | O=c1cc(-c2ccccc2)oc2ccc3ccccc3c12 |
| Clinical Status | Data-mined Candidate |
| Targets (Human+Pathogen) | 2 |
| Pfam Stratification | Homologous |
| Avg pChEMBL | 7.08 |
| Source | ChEMBL;BindingDB |
2D Structure
Activity Profile
DrugBank Annotations
| DrugBank ID | DB06732 |
|---|---|
| Drug Name | beta-Naphthoflavone |
| CAS Number | 6051-87-2 |
| Groups | experimental |
| ATC Codes | nan |
| Description | β-Naphthoflavone, also known as 5,6-benzoflavone, is a potent agonist of the aryl hydrocarbon receptor and induces cytochromes P450 (CYPs) and uridine 5'-diphospho-glucuronosyltransferases (UGTs). It may be a chemopreventive agent. |
Categories: Benzoflavones Benzopyrans Chromones Cytochrome P-450 CYP1A2 Inducers Cytochrome P-450 CYP1A2 Inducers (strength unknown) Cytochrome P-450 Enzyme Inducers Enzyme Inhibitors Flavonoids Heterocyclic Compounds, Fused-Ring Pyrans
Cross-references: BindingDB: 50028963 ChEBI: 77013 CHEMBL26260 ChemSpider: 2271 PubChem:2361 PubChem:99443278 Wikipedia: Beta-Naphthoflavone ZINC: ZINC000000057645
Target Activities (2)
DrugBank Target Actions (6)
| Target | Gene | Target Name | Action | Type |
|---|---|---|---|---|
| P05177 | CYP1A2 | Cytochrome P450 1A2 | inducer | enzymes |
| P35869 | AHR | Aryl hydrocarbon receptor | agonist | targets |
| P03372 | ESR1 | Estrogen receptor | binder | targets |
| P10589 | P10589 | COUP transcription factor 1 | binder | targets |
| P11474 | ESRRA | Steroid hormone receptor ERR1 | binder | targets |
| Q16678 | CYP1B1 | Cytochrome P450 1B1 | binder | targets |