Ligand name: N-{4-[4-amino-7-(propan-2-yl)-7H-pyrrolo[2,3-d]pyrimidine-5-carbonyl]pyridin-2-yl}-N'-(2,4-difluorophenyl)urea
PDB ligand accession: 6K0
DrugBank: n/a
PubChem: 68904737
ChEMBL: CHEMBL4744936
InChI Key: RPNUUULYRBUSBJ-UHFFFAOYSA-N
SMILES: CC(C)n1cc(c2c1ncnc2N)C(=O)c3ccnc(c3)NC(=O)Nc4ccc(cc4F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: N-phenylureas

List of PDB structures and/or AlphaFold models with target protein P04629

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5JFS	Download	Experimental	e5jfsA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot