Ligand name: (2S)-4-(2,5-difluorophenyl)-N-[(3R,4S)-3-fluoro-1-methylpiperidin-4-yl]-2-(hydroxymethyl)-N-methyl-2-phenyl-2,5-dihydro-1H-pyrrole-1-carboxamide
PDB ligand accession: K30
DrugBank: DB08037
PubChem: 11655511
ChEMBL: CHEMBL481931
InChI Key: MYBGWENAVMIGMM-GIFXNVAJSA-N
SMILES: CN1CCC(C(C1)F)N(C)C(=O)N2CC(=CC2(CO)c3ccccc3)c4cc(ccc4F)F
Drug action: inhibitor

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolines
      • Subclass: Phenylpyrrolines

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P52732

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3CJO	Download	Experimental	e3cjoA1 e3cjoB1	P-loop domains-like P-loop domains-like	LigPlot