Ligand name: 4-{[(2-carbamoyl-4-nitrophenyl)amino]methyl}benzoic acid
PDB ligand accession: X9I
DrugBank: n/a
PubChem: 25161448
ChEMBL: CHEMBL1416877
InChI Key: CASBTGCUPQIBNJ-UHFFFAOYSA-N
SMILES: c1cc(ccc1CNc2ccc(cc2C(=O)N)[N+](=O)[O-])C(=O)O
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 P24941

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3R7I	Download	Experimental	e3r7iA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot