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Assay Detail

CHEMBL828540

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

Binding
Binding affinity for human Estrogen receptor beta
14
Total Activities
7
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Expert

Target

Estrogen receptor beta (CHEMBL242)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Structure-based virtual screening for plant-based ERbeta-selective ligands as potential preventative therapy against age-related neurodegenerative diseases.
Zhao L, Brinton RD.
J Med Chem (2005) 48 : 3463 -3466
PubMed 15887952 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 14 6.11 7.73

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL30707 COUMESTROL 2 7.73
CHEMBL44 GENISTEIN 2.0 2 7.01
CHEMBL193518 2 6.60
CHEMBL195560 ISOPHENOXODIOL 3.0 2 6.17
CHEMBL8145 DAIDZEIN 2.0 2 5.55
CHEMBL424829 2 5.35
CHEMBL370039 2 4.37

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL30707 COUMESTROL IC50 = 18.6 nM 7.73
CHEMBL30707 COUMESTROL IC50 = 18.6 nM 7.73
CHEMBL44 GENISTEIN IC50 = 98.7 nM 7.01
CHEMBL44 GENISTEIN IC50 = 98.7 nM 7.01
CHEMBL193518 IC50 = 250.0 nM 6.60
CHEMBL193518 IC50 = 250.0 nM 6.60
CHEMBL195560 ISOPHENOXODIOL IC50 = 680.0 nM 6.17
CHEMBL195560 ISOPHENOXODIOL IC50 = 680.0 nM 6.17
CHEMBL8145 DAIDZEIN IC50 = 2800.0 nM 5.55
CHEMBL8145 DAIDZEIN IC50 = 2800.0 nM 5.55
CHEMBL424829 IC50 = 4480.0 nM 5.35
CHEMBL424829 IC50 = 4480.0 nM 5.35
CHEMBL370039 IC50 = 43000.0 nM 4.37
CHEMBL370039 IC50 = 43000.0 nM 4.37