Ligand name: tert-butyl (2-{[(2S)-3-oxo-2-(phenylamino)-3-{[(pyridin-3-yl)methyl]amino}propyl]sulfanyl}ethyl)carbamate
PDB ligand accession: 80K
DrugBank: n/a
PubChem: 131842076
ChEMBL: n/a
InChI Key: IEAGHLBQWKIVGS-LJQANCHMSA-N
SMILES: CC(C)(C)OC(=O)NCCSCC(C(=O)NCc1cccnc1)Nc2ccccc2

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 80K

#	DrugDomain Data	UniProt Accession	Drug Action	Affinity data
1	P08684_80K	P08684	n/a