Ligand name: 4-[3-(4-chlorophenyl)-2,1-benzisoxazol-5-yl]pyrimidin-2-amine
PDB ligand accession: VX1
DrugBank: DB08707
PubChem: 2765355
ChEMBL: CHEMBL409038
InChI Key: AQVFETGXIRKVAQ-UHFFFAOYSA-N
SMILES: c1cc(ccc1c2c3cc(ccc3no2)c4ccnc(n4)N)Cl
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazines
      • Subclass: Pyrimidines and pyrimidine derivatives

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P11309

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3BGP	Download	Experimental	e3bgpA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot