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Assay Detail

CHEMBL2380033

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Binding
Displacement of [3H] N-methylscopolamine from human muscarinic M3 receptor expressed in CHOK1 cells after 30 mins by scintillation counting analysis
18
Total Activities
18
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type CHO-K1
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Muscarinic acetylcholine receptor M3 (CHEMBL245)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Discovery of subtype selective muscarinic receptor antagonists as alternatives to atropine using in silico pharmacophore modeling and virtual screening methods.
Bhattacharjee AK, Pomponio JW, Evans SA, Pervitsky D, Gordon RK.
Bioorg Med Chem (2013) 21 : 2651 -2662
PubMed 23523385 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 18 7.50 9.27

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2377383 1 9.27
CHEMBL517712 ATROPINE 4.0 1 8.66
CHEMBL2377387 1 8.51
CHEMBL2106570 METHYLBENACTYZIUM BROMIDE 2.0 1 8.37
CHEMBL1101 BIPERIDEN 4.0 1 8.22
CHEMBL2377392 1 8.22
CHEMBL2377267 1 8.18
CHEMBL2377269 1 8.08
CHEMBL2377268 1 7.95
CHEMBL37372 1 7.28
CHEMBL2377261 1 7.23
CHEMBL2377262 1 6.96
CHEMBL2110892 BIETAMIVERINE 2.0 1 6.73
CHEMBL1191560 1 6.61
CHEMBL2377388 1 6.59
CHEMBL2377385 1 6.57
CHEMBL2377384 1 6.42
CHEMBL26505 APROFENE 2.0 1 5.11

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2377383 Ki = 0.543 nM 9.27
CHEMBL517712 ATROPINE Ki = 2.18 nM 8.66
CHEMBL2377387 Ki = 3.12 nM 8.51
CHEMBL2106570 METHYLBENACTYZIUM BROMIDE Ki = 4.25 nM 8.37
CHEMBL1101 BIPERIDEN Ki = 5.95 nM 8.22
CHEMBL2377392 Ki = 5.97 nM 8.22
CHEMBL2377267 Ki = 6.55 nM 8.18
CHEMBL2377269 Ki = 8.37 nM 8.08
CHEMBL2377268 Ki = 11.2 nM 7.95
CHEMBL37372 Ki = 52.2 nM 7.28
CHEMBL2377261 Ki = 59.0 nM 7.23
CHEMBL2377262 Ki = 109.0 nM 6.96
CHEMBL2110892 BIETAMIVERINE Ki = 186.0 nM 6.73
CHEMBL1191560 Ki = 243.0 nM 6.61
CHEMBL2377388 Ki = 254.0 nM 6.59
CHEMBL2377385 Ki = 270.0 nM 6.57
CHEMBL2377384 Ki = 384.0 nM 6.42
CHEMBL26505 APROFENE Ki = 7760.0 nM 5.11