Ligand name: N-[(1S)-2-{[(3S)-1-benzyl-3-cyanopyrrolidin-3-yl]amino}-1-(cyclohexylmethyl)-2-oxoethyl]morpholine-4-carboxamide
PDB ligand accession: Y14
DrugBank: n/a
PubChem: 49867880
ChEMBL: n/a
InChI Key: OHVQFYYBGNOGJV-JYFHCDHNSA-N
SMILES: c1ccc(cc1)CN2CCC(C2)(C#N)NC(=O)C(CC3CCCCC3)NC(=O)N4CCOCC4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Phenylmethylamines

List of PDB structures and/or AlphaFold models with target protein P25774

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2R9N	Download	Experimental	e2r9nA1 e2r9nB1	Cysteine proteinases-like Cysteine proteinases-like	LigPlot