Ligand name: N-{3-[(2-{[4-(4-methylpiperazin-1-yl)phenyl]amino}-7H-pyrrolo[2,3-d]pyrimidin-4-yl)oxy]phenyl}propanamide
PDB ligand accession: 633
DrugBank: n/a
PubChem: 137348422
ChEMBL: n/a
InChI Key: JZXKYJJXGSXWTQ-UHFFFAOYSA-N
SMILES: CCC(=O)Nc1cccc(c1)Oc2c3cc[nH]c3nc(n2)Nc4ccc(cc4)N5CCN(CC5)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Diazinanes
      • Subclass: Piperazines

List of PDB structures and/or AlphaFold models with target protein P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5HG5	Download	Experimental	e5hg5A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot