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Assay Detail

CHEMBL5227857

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Displacement of [3H]U69593 from human KOR expressed in CHO cell membranes incubated for 30 mins by liquid scintillation counting method
36
Total Activities
36
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type CHO
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Kappa-type opioid receptor (CHEMBL237)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery, Structure-Activity Relationship, and Mechanistic Studies of 1-((3<i>R</i>,4<i>S</i>)-3-((Dimethylamino)methyl)-4-hydroxy-4-(3-methoxyphenyl)piperidin-1-yl)-2-(2,4,5-trifluorophenyl)ethan-1-one as a Novel Potent Analgesic.
Huang H, Li X, Xie P, Li X, Xu X, Qian Y, Yuan C, Meng X, Chai J, Chen J, Liu J, Wang W, Li W, Wang Y, Fu W, Liu J.
J Med Chem (2021) 64 : 9458 -9483
PubMed 34152138 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 36 6.61 9.05

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL290543 1 9.05
CHEMBL5277326 1 8.10
CHEMBL5270915 1 7.71
CHEMBL5272486 1 7.38
CHEMBL5287134 1 7.37
CHEMBL5272258 1 7.37
CHEMBL5275873 1 7.21
CHEMBL5273356 1 7.19
CHEMBL5274664 1 7.13
CHEMBL5272171 1 7.03
CHEMBL5269558 1 7.03
CHEMBL5287792 1 6.98
CHEMBL5279890 1 6.90
CHEMBL5281054 1 6.79
CHEMBL5274208 1 6.77
CHEMBL5281561 1 6.77
CHEMBL5288358 1 6.69
CHEMBL5281864 1 6.64
CHEMBL5272744 1 6.62
CHEMBL5282901 1 6.56
CHEMBL5275209 1 6.54
CHEMBL5274117 1 6.19
CHEMBL5277743 1 6.17
CHEMBL5277164 1 6.17
CHEMBL5281114 1 6.00
CHEMBL5270488 1 5.89
CHEMBL5285920 1 5.77
CHEMBL5283662 1 5.70
CHEMBL5278225 1 5.63
CHEMBL5287093 1 5.58

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL290543 Ki = 0.9 nM 9.05
CHEMBL5277326 Ki = 7.9 nM 8.10
CHEMBL5270915 Ki = 19.7 nM 7.71
CHEMBL5272486 Ki = 41.9 nM 7.38
CHEMBL5287134 Ki = 42.3 nM 7.37
CHEMBL5272258 Ki = 43.1 nM 7.37
CHEMBL5275873 Ki = 61.2 nM 7.21
CHEMBL5273356 Ki = 64.1 nM 7.19
CHEMBL5274664 Ki = 74.4 nM 7.13
CHEMBL5269558 Ki = 93.6 nM 7.03
CHEMBL5272171 Ki = 94.2 nM 7.03
CHEMBL5287792 Ki = 104.9 nM 6.98
CHEMBL5279890 Ki = 126.9 nM 6.90
CHEMBL5281054 Ki = 163.9 nM 6.79
CHEMBL5281561 Ki = 169.3 nM 6.77
CHEMBL5274208 Ki = 169.1 nM 6.77
CHEMBL5288358 Ki = 205.0 nM 6.69
CHEMBL5281864 Ki = 227.4 nM 6.64
CHEMBL5272744 Ki = 241.8 nM 6.62
CHEMBL5282901 Ki = 277.1 nM 6.56
CHEMBL5275209 Ki = 287.6 nM 6.54
CHEMBL5274117 Ki = 648.9 nM 6.19
CHEMBL5277743 Ki = 673.1 nM 6.17
CHEMBL5277164 Ki = 675.4 nM 6.17
CHEMBL5281114 Ki = 1009.0 nM 6.00
CHEMBL5270488 Ki = 1277.0 nM 5.89
CHEMBL5285920 Ki = 1701.0 nM 5.77
CHEMBL5283662 Ki = 1987.0 nM 5.70
CHEMBL5278225 Ki = 2357.0 nM 5.63
CHEMBL5287093 Ki = 2651.0 nM 5.58
CHEMBL5268603 Ki = 3031.0 nM 5.52
CHEMBL5288272 Ki = 3098.0 nM 5.51
CHEMBL5273683 Ki = 4055.0 nM 5.39
CHEMBL5290025 Ki = 4424.0 nM 5.35
CHEMBL5269806 Ki > 5000.0 nM -
CHEMBL5283376 Ki > 5000.0 nM -