Ligand name: 3-[({2-[2-(1H-imidazol-1-yl)pyrimidin-4-yl]ethyl}amino)methyl]benzonitrile
PDB ligand accession: OLW
DrugBank: n/a
PubChem: 118656539
ChEMBL: CHEMBL3547101
InChI Key: ODSRQJVZWSSZFG-UHFFFAOYSA-N
SMILES: c1cc(cc(c1)C#N)CNCCc2ccnc(n2)n3ccnc3
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 P29475

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4UCH	Download	Experimental	e4uchA1 e4uchB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot