Ligand name: [(2~{S},5~{S})-2-[[(5-bromanylpyridin-2-yl)amino]methyl]-5-methyl-piperidin-1-yl]-(3-fluoranyl-2-methoxy-phenyl)methanone
PDB ligand accession: NRE
DrugBank: n/a
PubChem: 44463491
ChEMBL: CHEMBL2413522
InChI Key: TWCRHJLMMAYSTE-ZFWWWQNUSA-N
SMILES: CC1CCC(N(C1)C(=O)c2cccc(c2OC)F)CNc3ccc(cn3)Br
Drug action: n/a

ClassyFire chemical classification:

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

List of PDB structures and/or AlphaFold models with target protein O43613

PDB/AF Accession	PyMOL script	Experimental / Predicted	Interacting ECOD domains	ECOD X-group name	LigPlot
6TOS	Download	Experimental	e6tosA1 e6tosB1	Family A G protein-coupled receptor-like Family A G protein-coupled receptor-like	LigPlot