Ligand name: 6-{[(3-fluorophenyl)methyl]sulfanyl}-5-(2-methylphenyl)-2,5-dihydro-4H-pyrazolo[3,4-d]pyrimidin-4-one
PDB ligand accession: M39
DrugBank: n/a
PubChem: 3248741
ChEMBL: CHEMBL4217738
InChI Key: SSEVBNPAVKLWFQ-UHFFFAOYSA-N
SMILES: Cc1ccccc1N2C(=O)c3c[nH]nc3N=C2SCc4cccc(c4)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrazolopyrimidines
      • Subclass: Pyrazolo[3,4-d]pyrimidines

List of PDB structures and/or AlphaFold models with target protein P00352

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5TEI	Download	Experimental	e5teiA1 e5teiA2	ALDH-like ALDH-like	LigPlot