Ligand name: 2-amino-7-(pyridin-3-ylmethyl)-3,5-dihydro-4H-pyrrolo[3,2-d]pyrimidin-4-one
PDB ligand accession: BC3
DrugBank: DB02568
PubChem: 60817;135413525;
ChEMBL: CHEMBL311300
InChI Key: DOHVAKFYAHLCJP-UHFFFAOYSA-N
SMILES: c1cc(cnc1)Cc2c[nH]c3c2N=C(NC3=O)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyrimidines
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9BMI9

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3DJF	Download	Experimental	e3djfA1 e3djfB1 e3djfB1 e3djfC1 e3djfA1 e3djfC1	Phosphorylase/hydrolase-like Phosphorylase/hydrolase-like Phosphorylase/hydrolase-like Phosphorylase/hydrolase-like Phosphorylase/hydrolase-like Phosphorylase/hydrolase-like	LigPlot