Ligand name: N-(2,6-difluorobenzyl)-3-({[4-propyl-5-(pyrimidin-4-yl)-4H-1,2,4-triazol-3-yl]methyl}amino)benzamide
PDB ligand accession: QRX
DrugBank: n/a
PubChem: 11155477
ChEMBL: CHEMBL1738878
InChI Key: VWBSMGFTNCQOMB-UHFFFAOYSA-N
SMILES: CCCn1c(nnc1c2ccncn2)CNc3cccc(c3)C(=O)NCc4c(cccc4F)F
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P21146

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3PVW	Download	Experimental	e3pvwA6	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot