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Assay Detail

CHEMBL5442176

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

Binding
PDSP Secondary Binding target: CHRM5 - Compounds are tested at 10 uM concentration, plate are incubated at room temperature in the dark for 90 minutes. Reaction are stopped by vacuum filtration onto 0.3% polyethyleneimine soaked filter mats using Filtermate harvester. Scintillation cocktail is then melted onto microwave-dried filters on a hot plate and the radio activity is counted in Microbia counter. Compounds showing a minimum of 50% inhibition at 10 uM concentration are carried forward in this secondary binding assay to determine equilibrium binding affinity.
30
Total Activities
30
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Category PDSP assay
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Muscarinic acetylcholine receptor M5 (CHEMBL2035)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

EUbOPEN Chemogenomics Library - PDSP Secondary Binding
EUbOPEN
(2024)
· DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 30 6.14 8.91

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3545181 TIOTROPIUM BROMIDE 4.0 1 8.91
CHEMBL1722209 TOLTERODINE TARTRATE 4.0 1 8.41
CHEMBL1633 KETOTIFEN FUMARATE 4.0 1 7.01
CHEMBL4743049 1 6.53
CHEMBL2164327 1 6.51
CHEMBL281350 SB-224289 1 6.46
CHEMBL360648 1 6.33
CHEMBL103769 1 6.31
CHEMBL1474387 1 6.29
CHEMBL445102 1 6.24
CHEMBL3039520 LASMIDITAN 4.0 1 6.20
CHEMBL2048820 1 6.18
CHEMBL405355 NIGULDIPINE 2.0 1 6.14
CHEMBL2018875 1 6.08
CHEMBL43383 1 6.03
CHEMBL1263 SALMETEROL 4.0 1 6.01
CHEMBL2181226 1 5.90
CHEMBL79834 SPIRAMIDE 2.0 1 5.88
CHEMBL2024517 CARIPRAZINE HYDROCHLORIDE 4.0 1 5.84
CHEMBL4743495 1 5.66
CHEMBL214957 1 5.58
CHEMBL16192 CP-96345 1 5.31
CHEMBL2392141 1 5.28
CHEMBL1256750 1 5.23
CHEMBL3310783 1 5.18
CHEMBL3287574 1 5.16
CHEMBL2381848 PF-06291874 2.0 1 5.07
CHEMBL2440659 1 -
CHEMBL2435402 1 -
CHEMBL2182029 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3545181 TIOTROPIUM BROMIDE Ki = 1.22 nM 8.91
CHEMBL1722209 TOLTERODINE TARTRATE Ki = 3.864 nM 8.41
CHEMBL1633 KETOTIFEN FUMARATE Ki = 98.53 nM 7.01
CHEMBL4743049 Ki = 293.13 nM 6.53
CHEMBL2164327 Ki = 308.28 nM 6.51
CHEMBL281350 SB-224289 Ki = 344.0 nM 6.46
CHEMBL360648 Ki = 467.2 nM 6.33
CHEMBL103769 Ki = 490.8 nM 6.31
CHEMBL1474387 Ki = 510.27 nM 6.29
CHEMBL445102 Ki = 579.3 nM 6.24
CHEMBL3039520 LASMIDITAN Ki = 632.05 nM 6.20
CHEMBL2048820 Ki = 662.06 nM 6.18
CHEMBL405355 NIGULDIPINE Ki = 717.63 nM 6.14
CHEMBL2018875 Ki = 840.81 nM 6.08
CHEMBL43383 Ki = 944.28 nM 6.03
CHEMBL1263 SALMETEROL Ki = 971.3 nM 6.01
CHEMBL2181226 Ki = 1249.97 nM 5.90
CHEMBL79834 SPIRAMIDE Ki = 1310.54 nM 5.88
CHEMBL2024517 CARIPRAZINE HYDROCHLORIDE Ki = 1432.02 nM 5.84
CHEMBL4743495 Ki = 2191.04 nM 5.66
CHEMBL214957 Ki = 2641.8 nM 5.58
CHEMBL16192 CP-96345 Ki = 4935.15 nM 5.31
CHEMBL2392141 Ki = 5234.8 nM 5.28
CHEMBL1256750 Ki = 5914.25 nM 5.23
CHEMBL3310783 Ki = 6559.94 nM 5.18
CHEMBL3287574 Ki = 6848.57 nM 5.16
CHEMBL2381848 PF-06291874 Ki = 8582.23 nM 5.07
CHEMBL2440659 Ki > 10000.0 nM -
CHEMBL2435402 Ki > 10000.0 nM -
CHEMBL2182029 Ki > 10000.0 nM -