PDB ligand accession: R75
DrugBank: DB12319
InChI Key: WHQCHUCQKNIQEC-UHFFFAOYSA-N
SMILES: CCc1c(c2ccccc2o1)C(=O)c3cc(c(c(c3)Br)O)Br
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Organic oxygen compounds
- Class: Organooxygen compounds
- Subclass: Carbonyl compounds
- Class: Organooxygen compounds
- Superclass: Organic oxygen compounds
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
P11712 | Download | Predicted | P11712_F1_nD1 | Cytochrome P450 |
1OG2 | Predicted | e1og2A1 e1og2B1 | ||
1OG5 | Predicted | e1og5B1 e1og5A1 | ||
1R9O | Predicted | e1r9oA1 | ||
4NZ2 | Predicted | e4nz2A1 e4nz2B1 | ||
5A5I | Predicted | e5a5iA1 | ||
5A5J | Predicted | e5a5jA1 | ||
5K7K | Predicted | e5k7kA1 | ||
5W0C | Predicted | e5w0cA1 | ||
5X23 | Predicted | e5x23A1 | ||
5X24 | Predicted | e5x24A1 | ||
5XXI | Predicted | e5xxiA1 |