Ligand name: (3S,11S)-11-(3-chloro-4-hydroxy-5-methoxyphenyl)-3-phenyl-2,3,4,5,10,11-hexahydro-1H-dibenzo[b,e][1,4]diazepin-1-one
PDB ligand accession: 3T1
DrugBank: n/a
PubChem: 1092224
ChEMBL: CHEMBL2177558
InChI Key: OSQNVTKXOKFBHH-LMKMVOKYSA-N
SMILES: COc1cc(cc(c1O)Cl)C2C3=C(CC(CC3=O)c4ccccc4)Nc5ccccc5N2
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodiazepines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein P03367

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3T11	Download	Experimental	e3t11A1 e3t11B1	cradle loop barrel cradle loop barrel	LigPlot