Ligand name: 1-[(3S,4R)-4-[3,4-bis(fluoranyl)phenyl]-1-(2-methoxyethyl)pyrrolidin-3-yl]-3-(5-ethoxy-4-methyl-2-phenyl-pyrazol-3-yl)urea
PDB ligand accession: 7HF
DrugBank: n/a
PubChem: 118128728
ChEMBL: CHEMBL4090531
InChI Key: SQGLEZDWHPDRDX-NZQKXSOJSA-N
SMILES: CCOc1c(c(n(n1)c2ccccc2)NC(=O)NC3CN(CC3c4ccc(c(c4)F)F)CCOC)C
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organoheterocyclic compounds
    • Class: Azoles
      • Subclass: Pyrazoles

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
5H3Q	Download	Experimental	e5h3qA1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot