Ligand name: (~{E})-2-cyano-3-(3-methoxy-4-oxidanyl-phenyl)-~{N}-[5-(trifluoromethyl)-1,3,4-thiadiazol-2-yl]prop-2-enamide
PDB ligand accession: JWQ
DrugBank: n/a
PubChem: 146018262
ChEMBL: CHEMBL4792639
InChI Key: OVZPTQXGZKJHGH-XBXARRHUSA-N
SMILES: COc1cc(ccc1O)C=C(C#N)C(=O)Nc2nnc(s2)C(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

• Kingdom: Organic compounds
  • Superclass: Phenylpropanoids and polyketides
    • Class: Cinnamic acids and derivatives
      • Subclass: Hydroxycinnamic acids and derivatives

List of PDB structures and/or AlphaFold models with target protein P68400

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6RB1	Download	Experimental	e6rb1A1	Protein kinase/SAICAR synthase/ATP-grasp	LigPlot