Ligand name: 1-(4-fluorophenyl)-3-[4-(4-fluorophenyl)-1-methyl-3-(trifluoromethyl)-1H-pyrazol-5-yl]urea
PDB ligand accession: 3O6
DrugBank: n/a
PubChem: 2810695
ChEMBL: CHEMBL579640
InChI Key: BJWCFFZTMUBHLH-UHFFFAOYSA-N
SMILES: Cn1c(c(c(n1)C(F)(F)F)c2ccc(cc2)F)NC(=O)Nc3ccc(cc3)F
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 Q8I5R7

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4WI1	Download	Experimental	e4wi1A2 e4wi1A3 e4wi1B1 e4wi1B3	Class II aaRS and biotin synthetases IF3-like Class II aaRS and biotin synthetases IF3-like	LigPlot