Ligand name: 3-{(E)-2-[6-(cyclopropylamino)-9H-purin-9-yl]ethenyl}-4-methyl-N-[3-(4-methyl-1H-imidazol-1-yl)-5-(trifluoromethyl)phenyl]benzamide
PDB ligand accession: B91
DrugBank: n/a
PubChem: 44517649
ChEMBL: CHEMBL539433
InChI Key: XQBYDVRVYRYLCH-BQYQJAHWSA-N
SMILES: Cc1ccc(cc1C=Cn2cnc3c2ncnc3NC4CC4)C(=O)Nc5cc(cc(c5)n6cc(nc6)C)C(F)(F)F

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

List of proteins that are targets for B91

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P00520_B91	P00520	n/a