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Assay Detail

CHEMBL973055

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 HEK293 cells
19
Total Activities
19
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Cell Type HEK293
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Melatonin receptor type 1A (CHEMBL1945)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Design and synthesis of benzofuranic derivatives as new ligands at the melatonin-binding site MT3.
Ettaoussi M, Péres B, Klupsch F, Delagrange P, Boutin JA, Renard P, Caignard DH, Chavatte P, Berthelot P, Lesieur D, Yous S.
Bioorg Med Chem (2008) 16 : 4954 -4962
PubMed 18372181 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 19 6.52 9.70

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL45 MELATONIN 4.0 1 9.70
CHEMBL323332 1 9.22
CHEMBL504585 1 7.00
CHEMBL505744 1 6.72
CHEMBL522674 1 5.91
CHEMBL493424 1 5.57
CHEMBL494566 1 5.41
CHEMBL521826 1 5.27
CHEMBL493414 1 5.27
CHEMBL495232 1 5.09
CHEMBL446329 1 -
CHEMBL493579 1 -
CHEMBL521827 1 -
CHEMBL505118 1 -
CHEMBL522528 1 -
CHEMBL494567 1 -
CHEMBL495241 1 -
CHEMBL495399 1 -
CHEMBL493607 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL45 MELATONIN IC50 = 0.2 nM 9.70
CHEMBL323332 IC50 = 0.6 nM 9.22
CHEMBL504585 IC50 = 100.0 nM 7.00
CHEMBL505744 IC50 = 189.0 nM 6.72
CHEMBL522674 IC50 = 1220.0 nM 5.91
CHEMBL493424 IC50 = 2690.0 nM 5.57
CHEMBL494566 IC50 = 3880.0 nM 5.41
CHEMBL521826 IC50 = 5350.0 nM 5.27
CHEMBL493414 IC50 = 5320.0 nM 5.27
CHEMBL495232 IC50 = 8180.0 nM 5.09
CHEMBL446329 IC50 - -
CHEMBL493579 IC50 > 10000.0 nM -
CHEMBL521827 IC50 > 10000.0 nM -
CHEMBL505118 IC50 > 10000.0 nM -
CHEMBL522528 IC50 > 10000.0 nM -
CHEMBL494567 IC50 > 10000.0 nM -
CHEMBL495241 IC50 - -
CHEMBL495399 IC50 - -
CHEMBL493607 IC50 > 10000.0 nM -