Ligand name: 5-(2,2,2-Trifluoro-ethoxy)-pyridine-2-carboxylic acid [3-((S)-2-amino-1,4-dimethyl-6-oxo-1,4,5,6-tetrahydro-pyrimidin-4-yl)-phenyl]-amide
PDB ligand accession: WZV
DrugBank: n/a
PubChem: 49819211
ChEMBL: n/a
InChI Key: ZJFIBYCNZHIVEL-IBGZPJMESA-N
SMILES: CC1(CC(=O)N(C(=N1)N)C)c2cccc(c2)NC(=O)c3ccc(cn3)OCC(F)(F)F
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9Y5Z0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3ZKI	Download	Experimental	e3zkiA2 e3zkiA3 e3zkiB2 e3zkiB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot
3ZKS	Download	Experimental	e3zksA2 e3zksA3	cradle loop barrel cradle loop barrel	LigPlot
3ZKN	Download	Experimental	e3zknA2 e3zknA3 e3zknB2 e3zknB3	cradle loop barrel cradle loop barrel cradle loop barrel cradle loop barrel	LigPlot