Ligand name: N-(2-methyl-5-{[(2-morpholin-4-ylpyridin-4-yl)carbonyl]amino}phenyl)-6-({2-[(2S)-1-methylpyrrolidin-2-yl]ethyl}amino)py ridine-3-carboxamide
PDB ligand accession: KQ7
DrugBank: n/a
PubChem: 44472896
ChEMBL: n/a
InChI Key: DVPVWRYIDHDOOO-VWLOTQADSA-N
SMILES: Cc1ccc(cc1NC(=O)c2ccc(nc2)NCCC3CCCN3C)NC(=O)c4ccnc(c4)N5CCOCC5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Anilides

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
3KQ7	Download	Experimental	e3kq7A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot