Bioactivity Information

Brief Information of the Compound and Protein

Compound Name

Compound Info

(S)-(+)-N-((3-[1-Benzoyl-3-(3,4-dichlorophenyl)piperidin-3-yl]prop-1-yl)-4-phenylpiperidin-4-yl)-N-methylacetamine

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PubChem ID

CID: 219077

SID: 57304375

Canonical SMILES	CN(C(C)=O)C1(CCN(CCC[C@@]2(CCCN(C2)C(=O)c2ccccc2)c2ccc(Cl)c(Cl)c2)CC1)c1ccccc1 Show/Hide
Compound Formula	C35H41Cl2N3O2

Compound Structure

Protein Name

Protein Info

Neuromedin-K receptor

Protein Classification

Membrane receptor

Family A G protein-coupled receptor

Peptide receptor (family A GPCR)

Short peptide receptor (family A GPCR)

Neurokinin receptor

Uniprot ID

P29371

Gene Name

TACR3

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 = 0.21 nM	TI LI LO TS
2	Ki = 1.2 nM	TI LI LO TS
3	Ki = 1.585 nM	TI LI LO TS
CL000006	HEK293 Cell Line Info	Homo sapiens (Human)	12
1	Kd = 0.2 nM	TI LI LO TS
2	Kd = 0.22 nM	TI LI LO TS
3	Kd = 5.888 nM	TI LI LO TS
4	Kd = 16.98 nM	TI LI LO TS
5	Kd = 18.62 nM	TI LI LO TS
6	Kd = 29.51 nM	TI LI LO TS
7	Ki = 0.4 nM	TI LI LO TS
8	Ki = 0.5 nM	TI LI LO TS
9	Ki = 0.6 nM	TI LI LO TS
10	Ki = 2.1 nM	TI LI LO TS
11	Ki = 4.8 nM	TI LI LO TS
12	Ki = 10.8 nM	TI LI LO TS

Biochemical Assays

1	Ki = 0.1995 nM
2	Ki = 1.9 nM