Ligand name: 3-methyl-1-(5-oxohexyl)-7-propyl-3,7-dihydro-1H-purine-2,6-dione
PDB ligand accession: POY
DrugBank: DB06479
PubChem: 4938
ChEMBL: CHEMBL1079905
InChI Key: RBQOQRRFDPXAGN-UHFFFAOYSA-N
SMILES: CCCn1cnc2c1C(=O)N(C(=O)N2C)CCCCC(=O)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Imidazopyrimidines
      • Subclass: Purines and purine derivatives

List of PDB structures and/or AlphaFold models with target protein Q9AMP1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ARX	Download	Experimental	e3arxA3 e3arxA2	TIM beta/alpha-barrel FKBP-like	LigPlot
3AS2	Download	Experimental	e3as2A1	Immunoglobulin-like beta-sandwich	LigPlot