PDB ligand accession: YSY
DrugBank: DB11837
InChI Key: USUZGMWDZDXMDG-CYBMUJFWSA-N
SMILES: c1cc(c(cc1C#N)F)C2CCc3n2cnc3
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzonitriles
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P15538 | Download | Predicted | P15538_F1_nD1 | Cytochrome P450 |
6M7X | Predicted | e6m7xA1 e6m7xB1 |