Ligand name: 1-(6-((2-((6-amino-5-nitropyridin-2-yl)amino)ethyl)amino)-2-(2,4-dichlorophenyl)pyridin-3-yl)-4-methylpiperazin-2-one
PDB ligand accession: QQA
DrugBank: n/a
PubChem: 11548266
ChEMBL: CHEMBL1242830
InChI Key: KLSRELDSEJWOAS-UHFFFAOYSA-N
SMILES: CN1CCN(C(=O)C1)c2ccc(nc2c3ccc(cc3Cl)Cl)NCCNc4ccc(c(n4)N)[N+](=O)[O-]
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 P49841

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6V6L	Download	Experimental	e6v6lA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot