Ligand name: 3-(2-CHLOROPHENYL)-1-(2-{[(1S)-2-HYDROXY-1,2-DIMETHYLPROPYL]AMINO}PYRIMIDIN-4-YL)-1-(4-METHOXYPHENYL)UREA
PDB ligand accession: LIB
DrugBank: DB08095
PubChem: 6540299
ChEMBL: CHEMBL379760
InChI Key: ZWYFTKPEHRQCCW-HNNXBMFYSA-N
SMILES: CC(C(C)(C)O)Nc1nccc(n1)N(c2ccc(cc2)OC)C(=O)Nc3ccccc3Cl
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 P47811

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2GHL	Download	Experimental	e2ghlA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot