Ligand name: asciminib
PDB ligand accession: AY7
DrugBank: DB12597
PubChem: 72165228
ChEMBL: CHEMBL4208229
InChI Key: VOVZXURTCKPRDQ-CQSZACIVSA-N
SMILES: c1cc(ccc1NC(=O)c2cc(c(nc2)N3CCC(C3)O)c4ccn[nH]4)OC(F)(F)Cl
Drug action: inhibitor

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P00519

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5MO4	Download	Experimental	e5mo4A2	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot
8SSN	Download	Experimental	e8ssnA1 e8ssnB1	Protein kinase/SAICAR synthase/ATP-grasp Protein kinase/SAICAR synthase/ATP-grasp	LigPlot