Ligand name: N-[3-(4-{[(1S)-2-hydroxy-1-phenylethyl]amino}-6-phenylfuro[2,3-d]pyrimidin-5-yl)phenyl]-N~3~,N~3~-dimethyl-beta-alaninamide
PDB ligand accession: KJ8
DrugBank: n/a
PubChem: 71571535
ChEMBL: CHEMBL2347963
InChI Key: ASCVQXWPIHGQIB-RUZDIDTESA-N
SMILES: CN(C)CCC(=O)Nc1cccc(c1)c2c3c(ncnc3oc2c4ccccc4)NC(CO)c5ccccc5
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Furans
      • Subclass: Diphenylfurans

List of PDB structures and/or AlphaFold models with target protein P00533

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4JQ8	Download	Experimental	e4jq8A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot