PDB ligand accession: IBR
DrugBank: DB07955
InChI Key: SMKXVWWBCFWRMP-UHFFFAOYSA-N
SMILES: c1cc(c(cc1N)C=O)CC(=O)OCCBr
Drug action: inhibitor
ClassyFire chemical classification:
- Kingdom: Organic compounds
- Superclass: Benzenoids
- Class: Benzene and substituted derivatives
- Subclass: Benzoyl derivatives
- Class: Benzene and substituted derivatives
- Superclass: Benzenoids
PDB/AF Accession | PyMOL script | Experimental / Predicted | Interacting ECOD domains | ECOD X-group name |
---|---|---|---|---|
Q9UNI1 | Download | Predicted | Q9UNI1_F1_nD1 | cradle loop barrel |