Ligand name: methyl (2R)-2-[(4S)-6-(4-chlorophenyl)-8-methoxy-1-methyl-4H-[1,2,4]triazolo[4,3-a][1,4]benzodiazepin-4-yl]butanoate
PDB ligand accession: 31P
DrugBank: n/a
PubChem: 86277843
ChEMBL: CHEMBL3770568
InChI Key: WGMDCNPABCIZCD-UTKZUKDTSA-N
SMILES: CCC(C1c2nnc(n2-c3ccc(cc3C(=N1)c4ccc(cc4)Cl)OC)C)C(=O)OC
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 P25440

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5O3A	Download	Experimental	e5o3aA1	Bromodomain-like	LigPlot
4QEW	Download	Experimental	e4qewA1	Bromodomain-like	LigPlot