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Assay Detail

CHEMBL4767831

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

Binding
Displacement of [125l]-lodomelatonin from hamster brain cell QR2 incubated for 60 mins by scintillation counting analysis
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Cricetinae
Tissue Brain
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Tuning melatonin receptor subtype selectivity in oxadiazolone-based analogues: Discovery of QR2 ligands and NRF2 activators with neurogenic properties.
Herrera-Arozamena C,Estrada-Valencia M,Pérez C,Lagartera L,Morales-García JA,Pérez-Castillo A,Franco-Gonzalez JF,Michalska P,Duarte P,León R,López MG,Mills A,Gago F,García-Yagüe ÁJ,Fernández-Ginés R,Cuadrado A,Rodríguez-Franco MI
Eur J Med Chem (2020) 190 : 112090 -112090
PubMed 32018096 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 12 7.25 8.49

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4783454 1 8.49
CHEMBL4783536 1 8.18
CHEMBL4781688 1 8.03
CHEMBL4794450 1 7.46
CHEMBL45 MELATONIN 4.0 1 7.11
CHEMBL4791901 1 6.96
CHEMBL4796759 1 6.66
CHEMBL4797429 1 6.60
CHEMBL4797226 1 6.57
CHEMBL4794879 1 6.48
CHEMBL3580919 1 -
CHEMBL4794019 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4783454 Ki = 3.2 nM 8.49
CHEMBL4783536 Ki = 6.6 nM 8.18
CHEMBL4781688 Ki = 9.3 nM 8.03
CHEMBL4794450 Ki = 35.0 nM 7.46
CHEMBL45 MELATONIN Ki = 77.0 nM 7.11
CHEMBL4791901 Ki = 110.0 nM 6.96
CHEMBL4796759 Ki = 220.0 nM 6.66
CHEMBL4797429 Ki = 250.0 nM 6.60
CHEMBL4797226 Ki = 270.0 nM 6.57
CHEMBL4794879 Ki = 330.0 nM 6.48
CHEMBL3580919 Ki > 100.0 nM -
CHEMBL4794019 Ki > 10000.0 nM -