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

ClassyFire chemical classification:

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

List of proteins that are targets for 5XS

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	Q92793_5XS	Q92793	CREB-binding protein (Histone	n/a