Brief Information of the Compound and Protein
Compound Name
 Compound Info 
1-[(R)-4-(3,5-bis-trifluoromethyl-benzoyl)-3-(1H-indol-3-ylmethyl)-piperazin-1-yl]-propan-2-one O-[2-(1,1-dioxo-thiomorpholin-4-yl)-ethyl]-oxime
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 PubChem ID
CID: 44407908
Canonical SMILES
C/C(CN1CCN(C(=O)c2cc(C(F)(F)F)cc(C(F)(F)F)c2)[C@H](Cc2c[nH]c3ccccc23)C1)=N/OCCN1CCS(=O)(=O)CC1
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Compound Formula C31H35F6N5O4S
Compound Structure
Protein Name
 Protein Info 
Substance-P receptor
Protein Classification
Membrane receptor
>
Family A G protein-coupled receptor
>
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)  2
1
Kd = 0.1 nM
   TI
   LI
   LO
   TS
2
Ki = 2.512 nM
   TI
   LI
   LO
   TS