Ligand name: 5-phenethyl-7H-pyrrolo[2,3-d]pyrimidine-2,4-diamine
PDB ligand accession: H0V
DrugBank: n/a
PubChem: 86580355
ChEMBL: CHEMBL3318804
InChI Key: MGQFVODICYACIT-UHFFFAOYSA-N
SMILES: c1ccc(cc1)CCc2c[nH]c3c2c(nc(n3)N)N
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Pyrrolopyrimidines
      • Subclass: Pyrrolo[2,3-d]pyrimidines

List of PDB structures and/or AlphaFold models with target protein O76290

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4CM7	Download	Experimental	e4cm7A1 e4cm7B1 e4cm7C1 e4cm7D1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot