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Assay Detail

CHEMBL3745571

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

Binding
Displacement of 2-[125I]-iodomelatonin from human melatonin receptor MT2 expressed in CHO cells after 1 hr by gamma counting analysis
22
Total Activities
12
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

Melatonin receptor type 1B (CHEMBL1946)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Novel difluoroacetamide analogues of agomelatine and melatonin: probing the melatonin receptors for MT1selectivity
Zlotos DP, Riad NM, Osman MB, Dodda BR, Witt-Enderby PA
Medchemcomm (2015) 6 : 1340 -1344
· DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 22 8.06 9.07

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1946221 2 9.07
CHEMBL45 MELATONIN 4.0 1 9.02
CHEMBL322339 2 8.75
CHEMBL3742090 2 8.75
CHEMBL3739674 2 8.11
CHEMBL3741890 2 8.09
CHEMBL3739824 2 8.05
CHEMBL3741561 2 8.05
CHEMBL3740377 2 7.84
CHEMBL3740052 2 7.36
CHEMBL3260986 2 7.06
CHEMBL429392 1 6.45

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1946221 Ki = 0.85 nM 9.07
CHEMBL1946221 Ki = 0.8511 nM 9.07
CHEMBL45 MELATONIN Ki = 0.955 nM 9.02
CHEMBL322339 Ki = 1.778 nM 8.75
CHEMBL3742090 Ki = 1.778 nM 8.75
CHEMBL322339 Ki = 2.0 nM 8.70
CHEMBL3742090 Ki = 2.0 nM 8.70
CHEMBL3739674 Ki = 7.8 nM 8.11
CHEMBL3739674 Ki = 7.762 nM 8.11
CHEMBL3741890 Ki = 8.1 nM 8.09
CHEMBL3741890 Ki = 8.128 nM 8.09
CHEMBL3741561 Ki = 9.0 nM 8.05
CHEMBL3739824 Ki = 9.0 nM 8.05
CHEMBL3741561 Ki = 8.913 nM 8.05
CHEMBL3740377 Ki = 14.45 nM 7.84
CHEMBL3740377 Ki = 15.0 nM 7.82
CHEMBL3739824 Ki = 21.38 nM 7.67
CHEMBL3740052 Ki = 44.0 nM 7.36
CHEMBL3740052 Ki = 43.65 nM 7.36
CHEMBL3260986 Ki = 87.1 nM 7.06
CHEMBL3260986 Ki = 87.0 nM 7.06
CHEMBL429392 Ki = 354.81 nM 6.45