Ligand name: 4-benzyl-3-[(2-chlorobenzyl)sulfanyl]-5-thiophen-2-yl-4H-1,2,4-triazole
PDB ligand accession: TT1
DrugBank: n/a
PubChem: 18288125
ChEMBL: CHEMBL253519
InChI Key: FMDVHVQWAJPVKM-UHFFFAOYSA-N
SMILES: c1ccc(cc1)Cn2c(nnc2SCc3ccccc3Cl)c4cccs4
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Organosulfur compounds
    • Class: Thioethers
      • Subclass: Aryl thioethers

List of PDB structures and/or AlphaFold models with target protein P04585

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
2RKI	Download	Experimental	e2rkiA9 e2rkiA12 e2rkiB2	Ribonuclease H-like Alpha-beta plaits Alpha-beta plaits	LigPlot