Ligand name: (2S)-2-(4-chlorophenyl)-N-{2-[3-methoxy-4-(prop-2-yn-1-yloxy)phenyl]ethyl}-2-(prop-2-yn-1-yloxy)ethanamide
PDB ligand accession: 3UZ
DrugBank: n/a
PubChem: 76961316
ChEMBL: n/a
InChI Key: KWLVWJPJKJMCSH-QFIPXVFZSA-N
SMILES: COc1cc(ccc1OCC#C)CCNC(=O)C(c2ccc(cc2)Cl)OCC#C
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein Q9CAJ0

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
8EY0	Download	Experimental	e8ey0B1 e8ey0A1	Ntn/PP2C TBP-like	LigPlot
4WVO	Download	Experimental	e4wvoA1 e4wvoB1	TBP-like Ntn/PP2C	LigPlot