Ligand name: 4-[(3-azanyl-4-methoxy-phenyl)-methyl-amino]chromen-2-one
PDB ligand accession: 890
DrugBank: n/a
PubChem: 132992905
ChEMBL: CHEMBL4591592
InChI Key: BSBGOXRTSLNAPO-UHFFFAOYSA-N
SMILES: CN(c1ccc(c(c1)N)OC)C2=CC(=O)Oc3c2cccc3
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organic nitrogen compounds
    • Class: Organonitrogen compounds
      • Subclass: Amines

List of PDB structures and/or AlphaFold models with target protein Q2XVP4

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5XKG	Download	Experimental	e5xkgA1 e5xkgA2 e5xkgB1 e5xkgB2 e5xkgC2 e5xkgD1 e5xkgD2	Rossmann-like Bacillus chorismate mutase-like Bacillus chorismate mutase-like Rossmann-like Rossmann-like Rossmann-like Bacillus chorismate mutase-like	LigPlot