Ligand name: N-{1-[(2-chloro-6-fluorophenyl)methyl]-1H-pyrazol-3-yl}-5-[(1S)-1-(3-methyl-1H-pyrazol-1-yl)ethyl]-1,3,4-thiadiazol-2-amine
PDB ligand accession: 6KA
DrugBank: n/a
PubChem: 46944961
ChEMBL: n/a
InChI Key: NXJALABMYVGINA-LBPRGKRZSA-N
SMILES: Cc1ccn(n1)C(C)c2nnc(s2)Nc3ccn(n3)Cc4c(cccc4Cl)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Benzenoids
    • Class: Benzene and substituted derivatives
      • Subclass: Halobenzenes

List of PDB structures and/or AlphaFold models with target protein P9WGR1

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
5JFO	Download	Experimental	e5jfoA1 e5jfoB1 e5jfoC1 e5jfoD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot