Ligand name: 4-(2-hydroxyethyl)benzonitrile
PDB ligand accession: JMD
DrugBank: n/a
PubChem: 2800815
ChEMBL: CHEMBL4534422
InChI Key: RBSJBNYPTGMZIH-UHFFFAOYSA-N
SMILES: c1cc(ccc1CCO)C#N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P18031

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5QF1	Download	Experimental	e5qf1A1	Flavodoxin-like	LigPlot