Ligand name: 2-chloro-4-{(2-methylbenzyl)[(3S)-1-(methylsulfonyl)pyrrolidin-3-yl]amino}benzonitrile
PDB ligand accession: WOW
DrugBank: n/a
PubChem: 16661548
ChEMBL: CHEMBL601500
InChI Key: OTRAFCFYTZJLKH-IBGZPJMESA-N
SMILES: Cc1ccccc1CN(c2ccc(c(c2)Cl)C#N)C3CCN(C3)S(=O)(=O)C
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
3KBA	Download	Experimental	e3kbaA1 e3kbaB1	Nuclear receptor ligand-binding domain Nuclear receptor ligand-binding domain	LigPlot