Ligand name: 1-(4-aminobenzyl)-3-[(2S)-4-(methylsulfanyl)-1-{(2R)-2-[2-(methylsulfanyl)phenyl]pyrrolidin-1-yl}-1-oxobutan-2-yl]urea
PDB ligand accession: 7I6
DrugBank: n/a
PubChem: 72771088
ChEMBL: CHEMBL3797711
InChI Key: SXQHCTVKKRKZEF-LEWJYISDSA-N
SMILES: CSCCC(C(=O)N1CCCC1c2ccccc2SC)NC(=O)NCc3ccc(cc3)N

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 7I6

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P30405_7I6	P30405	n/a