Ligand name: N-{(3R,4S)-4-[(6-amino-4-methylpyridin-2-yl)methyl]pyrrolidin-3-yl}-N'-[2-(3-fluorophenyl)ethyl]ethane-1,2-diamine
PDB ligand accession: J11
DrugBank: n/a
PubChem: 45259040
ChEMBL: CHEMBL1233715
InChI Key: PUOKPLCASUFBAN-PXNSSMCTSA-N
SMILES: Cc1cc(nc(c1)N)CC2CNCC2NCCNCCc3cccc(c3)F
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P29476

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3JX4	Download	Experimental	e3jx4A1 e3jx4B1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot
3JWU	Download	Experimental	e3jwuA1 e3jwuB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot