Bioactivity Information

Brief Information of the Compound and Protein

Compound Name

Compound Info

5-(4-chlorophenyl)-1-(2,4-dichlorophenyl)-4-methyl-N-(piperidin-1-yl)-1H-pyrazole-3-carboxamide

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PubChem ID

CID: 104850

SID: 14809274

Canonical SMILES	Cc1c(nn(c1-c1ccc(Cl)cc1)-c1ccc(Cl)cc1Cl)C(=O)NN1CCCCC1 Show/Hide
Compound Formula	C22H21Cl3N4O

Compound Structure

Protein Name

Protein Info

Cannabinoid receptor 1

Protein Classification

Membrane receptor

Family A G protein-coupled receptor

Small molecule receptor (family A GPCR)

Lipid-like ligand receptor (family A GPCR)

Cannabinoid receptor

Uniprot ID

P21554

Gene Name

CNR1

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)	24
1	EC50 = 0.11 nM	TI LI LO TS
2	EC50 = 5 nM	TI LI LO TS
3	EC50 = 36 nM	TI LI LO TS
4	IC50 = 3.2 nM	TI LI LO TS
5	IC50 = 4.6 nM	TI LI LO TS
6	IC50 = 6 nM	TI LI LO TS
7	IC50 = 6.1 nM	TI LI LO TS
8	IC50 = 9.7 nM	TI LI LO TS
9	IC50 = 13 nM	TI LI LO TS
10	IC50 = 13.5 nM	TI LI LO TS
11	IC50 = 108 nM	TI LI LO TS
12	IC50 = 158.49 nM	TI LI LO TS
13	Kd = 2.512 nM	TI LI LO TS
14	Ki = 0.7 nM	TI LI LO TS
15	Ki = 0.74 nM	TI LI LO TS
16	Ki = 0.9333 nM	TI LI LO TS
17	Ki = 5.4 nM	TI LI LO TS
18	Ki = 6.2 nM	TI LI LO TS
19	Ki = 8.9 nM	TI LI LO TS
20	Ki = 10.6 nM	TI LI LO TS
21	Ki = 11 nM	TI LI LO TS
22	Ki = 12.6 nM	TI LI LO TS
23	Ki = 25 nM	TI LI LO TS
24	Ki = 143 nM	TI LI LO TS
CL000026	CHO-K1 Cell Line Info	Cricetulus griseus (Chinese hamster)	11
1	EC50 = 240 nM	TI LI LO TS
2	IC50 = 2.9 nM	TI LI LO TS
3	IC50 = 4.5 nM	TI LI LO TS
4	IC50 = 6.9 nM	TI LI LO TS
5	IC50 = 120 nM	TI LI LO TS
6	Ki = 0.19 nM	TI LI LO TS
7	Ki = 1 nM	TI LI LO TS
8	Ki = 1.18 nM	TI LI LO TS
9	Ki = 1.6 nM	TI LI LO TS
10	Ki = 5.9 nM	TI LI LO TS
11	Ki = 6.2 nM	TI LI LO TS
CL000053	COS-7 Cell Line Info	Chlorocebus aethiops (Green monkey)	1
1	IC50 = 5.1 nM	TI LI LO TS
CL000006	HEK293 Cell Line Info	Homo sapiens (Human)	26
1	EC50 = 1.5 nM	TI LI LO TS
2	EC50 = 4.1 nM	TI LI LO TS
3	EC50 = 15.7 nM	TI LI LO TS
4	EC50 = 18.2 nM	TI LI LO TS
5	EC50 = 586 nM	TI LI LO TS
6	IC50 = 2.8 nM	TI LI LO TS
7	IC50 = 13.2 nM	TI LI LO TS
8	IC50 = 15 nM	TI LI LO TS
9	Kd = 1.8 nM	TI LI LO TS
10	Kd = 2.57 nM	TI LI LO TS
11	Ki = 0.9 nM	TI LI LO TS
12	Ki = 1.1 nM	TI LI LO TS
13	Ki = 1.18 nM	TI LI LO TS
14	Ki = 1.8 nM	TI LI LO TS
15	Ki = 1.9 nM	TI LI LO TS
16	Ki = 1.995 nM	TI LI LO TS
17	Ki = 2.1 nM	TI LI LO TS
18	Ki = 2.4 nM	TI LI LO TS
19	Ki = 6 nM	TI LI LO TS
20	Ki = 6.18 nM	TI LI LO TS
21	Ki = 7.1 nM	TI LI LO TS
22	Ki = 8 nM	TI LI LO TS
23	Ki = 12 nM	TI LI LO TS
24	Ki = 16 nM	TI LI LO TS
25	Ki = 18 nM	TI LI LO TS
26	Ki = 40 nM	TI LI LO TS
CL000065	HEK293-EBNA Cell Line Info	Homo sapiens (Human)	2
1	EC50 = 4 nM	TI LI LO TS
2	Ki = 7.3 nM	TI LI LO TS
CL000013	Sf9 Cell Line Info	Spodoptera frugiperda (Fall armyworm)	2
1	IC50 = 1.35 nM	TI LI LO TS
2	Ki = 0.43 nM	TI LI LO TS

Biochemical Assays

1	IC50 = 6.2 nM
2	IC50 = 13.5 nM
3	Ki = 0.037426 nM
4	Ki = 1.38 nM
5	Ki = 1.4 nM
6	Ki = 1.8 nM
7	Ki = 1.98 nM
8	Ki = 2.4 nM
9	Ki = 5.37 nM
10	Ki = 5.6 nM
11	Ki = 7.3 nM
12	Ki = 8.9 nM
13	Ki = 10.6 nM
14	Ki = 12 nM

Cite

About MolBiC

Correspondence

Prof. Feng ZHU

Prof. Leo, Lianyi Han