PDB ligand accession: VOR
DrugBank: DB00582
PubChem:
ChEMBL:
InChI Key: BCEHBSKCWLPMDN-MGPLVRAMSA-N
SMILES: CC(c1c(cncn1)F)C(Cn2cncn2)(c3ccc(cc3F)F)O
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Phenylpropanes
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
# | DrugDomain Data | UniProt Accession | Protein name | Drug Action | Affinity data |
---|---|---|---|---|---|
1 | A6ZSR0_VOR | A6ZSR0 | sterol 14alpha-demethylase (EC | n/a | |
2 | Q96W81_VOR | Q96W81 | 14-alpha sterol demethylase | n/a | |
3 | A0A2H4A2U9_VOR | A0A2H4A2U9 | CYP51, sterol 14alpha-demethylase | n/a | |
4 | P14779_VOR | P14779 | Bifunctional cytochrome P450/NADPH--P450 | n/a | |
5 | Q9Y6A2_VOR | Q9Y6A2 | Cholesterol 24-hydroxylase (CH24H) | n/a | IC50(nM) = 10000.0 |