Ligand name: 3-{5-[(2E,4aR,7aR)-6-benzoyl-2-imino-3-methyl-4-oxooctahydro-7aH-pyrrolo[3,4-d]pyrimidin-7a-yl]thiophen-3-yl}benzonitrile
PDB ligand accession: 10J
DrugBank: n/a
PubChem: 60210990
ChEMBL: CHEMBL2178145
InChI Key: POOXGNGZUXTIQE-CPJSRVTESA-N
SMILES: CN1C(=O)C2CN(CC2(NC1=N)c3cc(cs3)c4cccc(c4)C#N)C(=O)c5ccccc5

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic acids and derivatives
    • Class: Carboxylic acids and derivatives
      • Subclass: Amino acids, peptides, and analogues

List of proteins that are targets for 10J

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P56817_10J	P56817	Beta-secretase 1 (EC	n/a