Ligand name: 6-({5-fluoro-2-[(3,4,5-trimethoxyphenyl)amino]pyrimidin-4-yl}amino)-2,2-dimethyl-2H-pyrido[3,2-b][1,4]oxazin-3(4H)-one
PDB ligand accession: 585
DrugBank: DB07159
PubChem: 11213558
ChEMBL: CHEMBL475251
InChI Key: NHHQJBCNYHBUSI-UHFFFAOYSA-N
SMILES: CC1(C(=O)Nc2c(ccc(n2)Nc3c(cnc(n3)Nc4cc(c(c(c4)OC)OC)OC)F)O1)C
Drug action: inhibitor

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P43405

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3FQS	Download	Experimental	e3fqsA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot