Ligand name: 3-butyl-8-[(6-butyl-5,7-dimethyl-[1,2,4]triazolo[1,5-a]pyrimidin-2-yl)sulfanylmethyl]-7-ethyl-purine-2,6-dione
PDB ligand accession: 5NQ
DrugBank: n/a
PubChem: 60498769
ChEMBL: CHEMBL3774931
InChI Key: FTDVJTZJKKOHSY-UHFFFAOYSA-N
SMILES: CCCCc1c(nc2nc(nn2c1C)SCc3nc4c(n3CC)C(=O)NC(=O)N4CCCC)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 O60885

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5EGU	Download	Experimental	e5eguA1 e5eguB1 e5eguC1 e5eguD1	Bromodomain-like Bromodomain-like Bromodomain-like Bromodomain-like	LigPlot