Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-Aza-bicyclo[2.2.2]octane-4-carboxylic acid [(S)-4-(3,5-bis-trifluoromethyl-phenyl)-1-(1H-indol-3-ylmethyl)-2-oxo-butyl]-amide
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 PubChem ID
CID: 9938657
SID: 15037209
Canonical SMILES
FC(F)(F)c1cc(CCC(=O)[C@H](Cc2c[nH]c3ccccc23)NC(=O)C23CCN(CC2)CC3)cc(c1)C(F)(F)F
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Compound Formula C29H29F6N3O2
Compound Structure
Protein Name
 Protein Info 
Substance-P receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
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Peptide receptor (family A GPCR)
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Short peptide receptor (family A GPCR)
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Neurokinin receptor
Uniprot ID
P25103
Gene Name
TACR1
Table of Molecular Bioactivities Related to the Compound and Protein
Cell-based Assay
Cell Line ID Cell Line Name Cell Line Organism
CL000011 CHO
 Cell Line Info 
Cricetulus griseus (Chinese hamster)  3
1
IC50 = 0.9 nM
   TI
   LI
   LO
   TS
2
IC50 = 1 nM
   TI
   LI
   LO
   TS
3
IC50 = 8 nM
   TI
   LI
   LO
   TS