Ligand name: (2E)-3-(3-chloro-5-{2-[2-(2,4-dioxo-3,4-dihydropyrimidin-1(2H)-yl)ethoxy]phenoxy}phenyl)prop-2-enenitrile
PDB ligand accession: 3X6
DrugBank: n/a
PubChem: 86573676
ChEMBL: CHEMBL3342966
InChI Key: QQWLDKMLZHRQRI-ONEGZZNKSA-N
SMILES: c1ccc(c(c1)OCCN2C=CC(=O)NC2=O)Oc3cc(cc(c3)Cl)C=CC#N
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein P03366

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
4RW9	Download	Experimental	e4rw9A1 e4rw9A2	Ribonuclease H-like Alpha-beta plaits	LigPlot
4RW7	Download	Experimental	e4rw7A2 e4rw7A3	Alpha-beta plaits Ribonuclease H-like	LigPlot
4RW8	Download	Experimental	e4rw8A2 e4rw8A4	Ribonuclease H-like Alpha-beta plaits	LigPlot