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Assay Detail

CHEMBL838862

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

Binding
Binding affinity against nicotinic acetylcholine receptor alpha4-beta2 in human HEK293 cells using [3H]- nicotine as radioligand
27
Total Activities
27
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HEK293
Confidence 7 — Homologous single protein target
Curated By Autocuration

Target

Neuronal acetylcholine receptor; alpha4/beta2 (CHEMBL1907589)
Type PROTEIN COMPLEX
Organism Homo sapiens

Publication

In pursuit of alpha4beta2 nicotinic receptor partial agonists for smoking cessation: carbon analogs of (-)-cytisine.
Coe JW, Vetelino MG, Bashore CG, Wirtz MC, Brooks PR, Arnold EP, Lebel LA, Fox CB, Sands SB, Davis TI, Schulz DW, Rollema H, Tingley FD, O'Neill BT.
Bioorg Med Chem Lett (2005) 15 : 2974 -2979
PubMed 15908213 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 27 7.97 9.64

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL497939 CYTISINICLINE 3.0 1 9.64
CHEMBL365965 1 9.36
CHEMBL187992 1 8.85
CHEMBL3 NICOTINE 4.0 1 8.80
CHEMBL191867 1 8.70
CHEMBL190502 1 8.54
CHEMBL191174 1 8.31
CHEMBL373359 1 8.24
CHEMBL191988 1 8.19
CHEMBL190826 1 8.19
CHEMBL189968 1 8.15
CHEMBL264986 1 7.89
CHEMBL190192 1 7.89
CHEMBL365578 1 7.85
CHEMBL191784 1 7.47
CHEMBL373144 1 7.47
CHEMBL193889 1 7.14
CHEMBL425906 1 7.05
CHEMBL189973 1 6.70
CHEMBL192726 1 6.58
CHEMBL189898 1 6.43
CHEMBL190749 1 -
CHEMBL193144 1 -
CHEMBL190013 1 -
CHEMBL371397 1 -
CHEMBL190754 1 -
CHEMBL193005 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL497939 CYTISINICLINE Ki = 0.23 nM 9.64
CHEMBL365965 Ki = 0.44 nM 9.36
CHEMBL187992 Ki = 1.4 nM 8.85
CHEMBL3 NICOTINE Ki = 1.6 nM 8.80
CHEMBL191867 Ki = 2.0 nM 8.70
CHEMBL190502 Ki = 2.9 nM 8.54
CHEMBL191174 Ki = 4.9 nM 8.31
CHEMBL373359 Ki = 5.7 nM 8.24
CHEMBL191988 Ki = 6.5 nM 8.19
CHEMBL190826 Ki = 6.5 nM 8.19
CHEMBL189968 Ki = 7.0 nM 8.15
CHEMBL264986 Ki = 13.0 nM 7.89
CHEMBL190192 Ki = 13.0 nM 7.89
CHEMBL365578 Ki = 14.0 nM 7.85
CHEMBL191784 Ki = 34.0 nM 7.47
CHEMBL373144 Ki = 34.0 nM 7.47
CHEMBL193889 Ki = 72.0 nM 7.14
CHEMBL425906 Ki = 90.0 nM 7.05
CHEMBL189973 Ki = 200.0 nM 6.70
CHEMBL192726 Ki = 264.0 nM 6.58
CHEMBL189898 Ki = 370.0 nM 6.43
CHEMBL190749 Ki > 500.0 nM -
CHEMBL193144 Ki > 500.0 nM -
CHEMBL190013 Ki > 500.0 nM -
CHEMBL371397 Ki > 500.0 nM -
CHEMBL190754 Ki > 500.0 nM -
CHEMBL193005 Ki > 500.0 nM -