Ligand name: 2-[5-(cyclopropylmethyl)-4-[(3-fluoro-4-sulfamoylphenyl)methyl]-3-{3-[(5-methylthiophen-2-yl)ethynyl]phenyl}-1H-pyrazol-1-yl]-1,3-thiazole-4-carboxylic acid
PDB ligand accession: P8V
DrugBank: n/a
PubChem: 139465347
ChEMBL: CHEMBL4753379
InChI Key: LZIKVHXLVMNROK-UHFFFAOYSA-N
SMILES: Cc1ccc(s1)C#Cc2cccc(c2)c3c(c(n(n3)c4nc(cs4)C(=O)O)CC5CC5)Cc6ccc(c(c6)F)S(=O)(=O)N
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 P00338

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6Q13	Download	Experimental	e6q13A1 e6q13A2 e6q13D2 e6q13B1 e6q13B2 e6q13C1 e6q13C2 e6q13A2 e6q13D1 e6q13D2	Rossmann-like LDH C-terminal domain-like LDH C-terminal domain-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like Rossmann-like LDH C-terminal domain-like	LigPlot