Ligand name: (3R)-3-benzyl-4-[(4-methoxyphenyl)sulfonyl]-1-[(1-methyl-1H-imidazol-5-yl)methyl]-2,3,4,5-tetrahydro-1H-1,4-benzodiazepine-7-carbonitrile
PDB ligand accession: 3PZ
DrugBank: n/a
PubChem: 644328
ChEMBL: CHEMBL1738728
InChI Key: BJWZXDNEKWSGQH-RUZDIDTESA-N
SMILES: Cn1cncc1CN2CC(N(Cc3c2ccc(c3)C#N)S(=O)(=O)c4ccc(cc4)OC)Cc5ccccc5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Benzodiazepines
      • Subclass: 1,4-benzodiazepines

List of PDB structures and/or AlphaFold models with target protein Q08603

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PZ2	Download	Experimental	e3pz2A1 e3pz2B1	Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot
3PZ1	Download	Experimental	e3pz1A1 e3pz1B1	Repetitive alpha hairpins Repetitive alpha hairpins	LigPlot