Ligand name: methyl 3-(7~{H}-purin-6-ylcarbamoyl)benzoate
PDB ligand accession: 5XS
DrugBank: n/a
PubChem: 123132879
ChEMBL: CHEMBL4210917
InChI Key: NEJKFBOKJSVKCS-UHFFFAOYSA-N
SMILES: COC(=O)c1cccc(c1)C(=O)Nc2c3c(nc[nH]3)ncn2
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q92793

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5H85	Download	Experimental	e5h85A1	Bromodomain-like	LigPlot