Ligand name: ~{N}-(4-cyanophenyl)ethanamide
PDB ligand accession: S0P
DrugBank: n/a
PubChem: 37256
ChEMBL: n/a
InChI Key: UFKRTEWFEYWIHD-UHFFFAOYSA-N
SMILES: CC(=O)Nc1ccc(cc1)C#N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9BRQ3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5R57	Download	Experimental	e5r57A1	beta-Grasp	LigPlot