Ligand name: 8-(1-benzothiophen-5-yl)-7-[(4-chlorophenyl)methyl]-6-{[(1R)-1-cyclopropylethyl]amino}-7H-purine-2-carboxylic acid
PDB ligand accession: 1GI
DrugBank: n/a
PubChem: 90319650
ChEMBL: CHEMBL5084175
InChI Key: VYDVBUHEXZQWED-CQSZACIVSA-N
SMILES: CC(C1CC1)Nc2c3c(nc(n3Cc4ccc(cc4)Cl)c5ccc6c(c5)ccs6)nc(n2)C(=O)O
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein Q00987

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7NA1	Download	Experimental	e7na1A1 e7na1B1	SWIB/MDM2 domain SWIB/MDM2 domain	LigPlot