Ligand name: N-cyclopropyl-N-(trans-4-pyridin-3-ylcyclohexyl)-4-[(1S)-2,2,2-trifluoro-1-hydroxy-1-methylethyl]benzamide
PDB ligand accession: D3E
DrugBank: DB07619
PubChem: n/a
ChEMBL: CHEMBL452587
InChI Key: FLRYWTWLHWACRP-GRWTVWFQSA-N
SMILES: CC(c1ccc(cc1)C(=O)N(C2CCC(CC2)c3cccnc3)C4CC4)(C(F)(F)F)O
Drug action: n/a

ClassyFire chemical classification:

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

List of drug binding-associated PTMs

List of PDB structures and/or AlphaFold models with target protein P28845

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
3D3E	Download	Experimental	e3d3eA1 e3d3eB1 e3d3eA1 e3d3eC1 e3d3eD1	Rossmann-like Rossmann-like Rossmann-like Rossmann-like Rossmann-like	LigPlot