Ligand name: 6-[(3-methylphenyl)sulfanyl]-2-[4-(pyridin-2-yl)piperazin-1-yl]-9H-purine
PDB ligand accession: JPF
DrugBank: n/a
PubChem: 165368524
ChEMBL: n/a
InChI Key: PIOPFGAPEWSFOW-UHFFFAOYSA-N
SMILES: Cc1cccc(c1)Sc2c3c([nH]cn3)nc(n2)N4CCN(CC4)c5ccccn5
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 Q9Y233

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5SIH	Download	Experimental	e5sihA1 e5sihB1 e5sihC1 e5sihD1	PDEase-like PDEase-like PDEase-like PDEase-like	LigPlot