Ligand name: (7R)-8-cyclopentyl-7-ethyl-5-methyl-2-(1H-pyrrol-2-yl)-7,8-dihydropteridin-6(5H)-one
PDB ligand accession: 1D1
DrugBank: n/a
PubChem: 67259851
ChEMBL: n/a
InChI Key: DBHNCRPFJNHKDP-CQSZACIVSA-N
SMILES: CCC1C(=O)N(c2cnc(nc2N1C3CCCC3)c4ccc[nH]4)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pteridines and derivatives
      • Subclass: None

List of PDB structures and/or AlphaFold models with target protein Q9NYY3

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4I5P	Download	Experimental	e4i5pA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot