Ligand name: 6-({(3S,4S)-4-[2-({2,2-difluoro-2-[(2R)-piperidin-2-yl]ethyl}amino)ethoxy]pyrrolidin-3-yl}methyl)-4-methylpyridin-2-amine
PDB ligand accession: 3XF
DrugBank: n/a
PubChem: 49837861
ChEMBL: n/a
InChI Key: PYDITBVREMCKIX-CGTJXYLNSA-N
SMILES: Cc1cc(nc(c1)N)CC2CNCC2OCCNCC(C3CCCCN3)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyridines and derivatives
      • Subclass: Aminopyridines and derivatives

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
3NLW	Download	Experimental	e3nlwA1 e3nlwB1	Nitric oxide (NO) synthase oxygenase domain Nitric oxide (NO) synthase oxygenase domain	LigPlot