Ligand name: 2-chloro-4-{[(3S)-1-methylpyrrolidin-3-yl][2-(trifluoromethyl)benzyl]amino}benzonitrile
PDB ligand accession: GKK
DrugBank: n/a
PubChem: 16661702
ChEMBL: CHEMBL558664
InChI Key: HMOAZJHSXXENHE-KRWDZBQOSA-N
SMILES: CN1CCC(C1)N(Cc2ccccc2C(F)(F)F)c3ccc(c(c3)Cl)C#N
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 P06401

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HQ5	Download	Experimental	e3hq5A1 e3hq5B1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot