Ligand name: benzyl (S)-1-((2S,3S)-1-(3-(6-amino-9H-purin-9-yl)propylamino)-2-hydroxy-1-oxopentan-3-ylamino)-4-methyl-1-oxopentan-2-ylcarbamate
PDB ligand accession: GRD
DrugBank: n/a
PubChem: 49867051
ChEMBL: n/a
InChI Key: JADHYPXMRTWESB-ONTIZHBOSA-N
SMILES: CCC(C(C(=O)NCCCn1cnc2c1ncnc2N)O)NC(=O)C(CC(C)C)NC(=O)OCc3ccccc3

ClassyFire chemical classification:

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

List of proteins that are targets for GRD

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P97571_GRD	P97571	Calpain-1 catalytic subunit	n/a