Ligand name: 1-benzyl-4-(benzyloxy)-3-bromopyridin-2(1H)-one
PDB ligand accession: P36
DrugBank: n/a
PubChem: 10126288
ChEMBL: CHEMBL1095447
InChI Key: VBZTXJCTVYBOKW-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CN2C=CC(=C(C2=O)Br)OCc3ccccc3
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3HP2	Download	Experimental	e3hp2A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot