Ligand name: 3-(2-chlorophenyl)-7-[(trans-4-hydroxycyclohexyl)amino]-3,4-dihydropyrimido[4,5-d]pyrimidin-2(1H)-one
PDB ligand accession: RO6
DrugBank: n/a
PubChem: n/a
ChEMBL: CHEMBL1235713
InChI Key: NSHBSERFNQQOCC-JOCQHMNTSA-N
SMILES: c1ccc(c(c1)N2Cc3cnc(nc3NC2=O)NC4CCC(CC4)O)Cl
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q16539

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3FSK	Download	Experimental	e3fskA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot