Ligand name: N-ethyl-4-{[5-(methoxycarbamoyl)-2-methylphenyl]amino}-5-methylpyrrolo[2,1-f][1,2,4]triazine-6-carboxamide
PDB ligand accession: 279
DrugBank: DB06940
PubChem: 10134493
ChEMBL: CHEMBL252128
InChI Key: ZZTMFGIGOADCFX-UHFFFAOYSA-N
SMILES: CCNC(=O)c1cn2c(c1C)c(ncn2)Nc3cc(ccc3C)C(=O)NOC
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

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
2RG5	Download	Experimental	e2rg5A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot