Ligand name: 4-(4-{[(2-chloro-6-fluorophenyl)carbamoyl]amino}-1H-pyrazol-1-yl)-N-(oxetan-3-yl)thiophene-2-carboxamide
PDB ligand accession: X3Y
DrugBank: n/a
PubChem: 155803726
ChEMBL: CHEMBL4778645
InChI Key: ANCCTLHKRLRSAF-UHFFFAOYSA-N
SMILES: c1cc(c(c(c1)Cl)NC(=O)Nc2cnn(c2)c3cc(sc3)C(=O)NC4COC4)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 P53779

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
7KSJ	Download	Experimental	e7ksjA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot