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Assay Detail

CHEMBL4252022

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

Binding
Displacement of 2-[125I]iodomelatonin from human MT1 receptor expressed in CHO cell membranes after 120 mins by filter binding method
30
Total Activities
26
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 1A (CHEMBL1945)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis and biological evaluation of new naphtho- and quinolinocyclopentane derivatives as potent melatoninergic (MT1/MT2) and serotoninergic (5-HT2C) dual ligands.
Duroux R, Rami M, Landagaray E, Ettaoussi M, Caignard DH, Delagrange P, Melnyk P, Yous S.
Eur J Med Chem (2017) 141 : 552 -566
PubMed 29102176 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 30 8.66 10.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL10878 AGOMELATINE 4.0 1 10.00
CHEMBL4278248 1 10.00
CHEMBL4293386 1 9.52
CHEMBL4278575 1 9.52
CHEMBL4281712 1 9.40
CHEMBL4279639 3 9.40
CHEMBL4292336 1 9.22
CHEMBL4288497 1 9.22
CHEMBL4280601 1 9.10
CHEMBL4286896 1 9.10
CHEMBL4280791 1 9.00
CHEMBL4283539 1 9.00
CHEMBL4291381 1 8.70
CHEMBL4285145 1 8.70
CHEMBL4290302 1 8.70
CHEMBL4281915 3 8.52
CHEMBL4288925 1 8.40
CHEMBL4292109 1 8.40
CHEMBL4294790 1 8.30
CHEMBL4277185 1 8.30
CHEMBL4289115 1 8.22
CHEMBL4286494 1 8.15
CHEMBL4278446 1 8.15
CHEMBL4284223 1 8.05
CHEMBL4277390 1 7.54
CHEMBL4288690 1 7.20

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL10878 AGOMELATINE Ki = 0.1 nM 10.00
CHEMBL4278248 Ki = 0.1 nM 10.00
CHEMBL4293386 Ki = 0.3 nM 9.52
CHEMBL4278575 Ki = 0.3 nM 9.52
CHEMBL4281712 Ki = 0.4 nM 9.40
CHEMBL4279639 Ki = 0.4 nM 9.40
CHEMBL4292336 Ki = 0.6 nM 9.22
CHEMBL4288497 Ki = 0.6 nM 9.22
CHEMBL4279639 Ki = 0.6 nM 9.22
CHEMBL4280601 Ki = 0.8 nM 9.10
CHEMBL4286896 Ki = 0.8 nM 9.10
CHEMBL4280791 Ki = 1.0 nM 9.00
CHEMBL4283539 Ki = 1.0 nM 9.00
CHEMBL4285145 Ki = 2.0 nM 8.70
CHEMBL4291381 Ki = 2.0 nM 8.70
CHEMBL4290302 Ki = 2.0 nM 8.70
CHEMBL4281915 Ki = 3.0 nM 8.52
CHEMBL4281915 Ki = 4.0 nM 8.40
CHEMBL4288925 Ki = 4.0 nM 8.40
CHEMBL4292109 Ki = 4.0 nM 8.40
CHEMBL4294790 Ki = 5.0 nM 8.30
CHEMBL4277185 Ki = 5.0 nM 8.30
CHEMBL4289115 Ki = 6.0 nM 8.22
CHEMBL4286494 Ki = 7.0 nM 8.15
CHEMBL4278446 Ki = 7.0 nM 8.15
CHEMBL4284223 Ki = 9.0 nM 8.05
CHEMBL4277390 Ki = 29.0 nM 7.54
CHEMBL4279639 Ki = 32.0 nM 7.50
CHEMBL4288690 Ki = 63.0 nM 7.20
CHEMBL4281915 Ki = 99.0 nM 7.00