Ligand name: N-({(2S,3S)-3-[(BENZYLAMINO)CARBONYL]OXIRAN-2-YL}CARBONYL)-L-ISOLEUCYL-L-PROLINE
PDB ligand accession: 78A
DrugBank: DB07231
PubChem: 23647361
ChEMBL: n/a
InChI Key: MERYMLLGRCNRKE-HILJTLORSA-N
SMILES: CCC(C)C(C(=O)N1CCCC1C(=O)O)NC(=O)C2C(O2)C(=O)NCc3ccccc3

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 78A

#	DrugDomain Data	UniProt Accession	Protein name	Drug Action	Affinity data
1	P07688_78A	P07688	Cathepsin B (EC	n/a	IC50(nM) = 29.0
2	P07858_78A	P07858	Cathepsin B (EC	n/a