Ligand name: [3-amino-2-(2-methylphenyl)-1-oxidopyridin-4-yl](2,4-difluorophenyl)methanone
PDB ligand accession: I39
DrugBank: n/a
PubChem: 24745781
ChEMBL: CHEMBL551717
InChI Key: LTGBWAXSDFOJNJ-UHFFFAOYSA-N
SMILES: Cc1ccccc1c2c(c(cc[n+]2[O-])C(=O)c3ccc(cc3F)F)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic oxygen compounds
    • Class: Organooxygen compounds
      • Subclass: Carbonyl compounds

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
3HRB	Download	Experimental	e3hrbA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot