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Assay Detail

CHEMBL5442211

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

Binding
PDSP Secondary Binding target: CHRM4 - 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.
13
Total Activities
13
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 M4 (CHEMBL1821)
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 13 6.66 9.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3545181 TIOTROPIUM BROMIDE 4.0 1 9.22
CHEMBL43383 1 7.87
CHEMBL59898 1 7.33
CHEMBL2048820 1 6.74
CHEMBL360648 1 6.60
CHEMBL4743049 1 6.35
CHEMBL2024517 CARIPRAZINE HYDROCHLORIDE 4.0 1 6.11
CHEMBL1474387 1 6.07
CHEMBL4164059 PITOLISANT HYDROCHLORIDE 4.0 1 6.05
CHEMBL1633 KETOTIFEN FUMARATE 4.0 1 6.04
CHEMBL214957 1 5.77
CHEMBL531742 1 5.71
CHEMBL23327 PURVALANOLA 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3545181 TIOTROPIUM BROMIDE Ki = 0.6 nM 9.22
CHEMBL43383 Ki = 13.59 nM 7.87
CHEMBL59898 Ki = 46.93 nM 7.33
CHEMBL2048820 Ki = 181.09 nM 6.74
CHEMBL360648 Ki = 248.86 nM 6.60
CHEMBL4743049 Ki = 443.96 nM 6.35
CHEMBL2024517 CARIPRAZINE HYDROCHLORIDE Ki = 778.76 nM 6.11
CHEMBL1474387 Ki = 854.47 nM 6.07
CHEMBL4164059 PITOLISANT HYDROCHLORIDE Ki = 899.29 nM 6.05
CHEMBL1633 KETOTIFEN FUMARATE Ki = 917.28 nM 6.04
CHEMBL214957 Ki = 1703.92 nM 5.77
CHEMBL531742 Ki = 1958.4 nM 5.71
CHEMBL23327 PURVALANOLA Ki > 10000.0 nM -