Ligand name: N~8~-(cyclopropylmethyl)-N~4~-(2-methylphenyl)-2-(piperazin-1-yl)pyrimido[5,4-d]pyrimidine-4,8-diamine
PDB ligand accession: XNA
DrugBank: n/a
PubChem: 53348215
ChEMBL: CHEMBL2017209
InChI Key: YOLJYZUKAHEMMW-UHFFFAOYSA-N
SMILES: Cc1ccccc1Nc2c3c(c(ncn3)NCC4CC4)nc(n2)N5CCNCC5
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 P50053-2

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3QA2	Download	Experimental	e3qa2B2 e3qa2A2 e3qa2B2	Rossmann-like Rossmann-like Rossmann-like	LigPlot