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Assay Detail

CHEMBL1840094

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

Binding
Inhibition of electric eel AChE using acetylthiocholine iodide as substrate by spectrophotometric method
15
Total Activities
15
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Electrophorus electricus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Acetylcholinesterase (CHEMBL4078)
Type SINGLE PROTEIN
Organism Electrophorus electricus

Publication

Benzofurans from Styrax agrestis as acetylcholinesterase inhibitors: structure-activity relationships and molecular modeling studies.
Liu J, Dumontet V, Simonin AL, Iorga BI, Guerineau V, Litaudon M, Nguyen VH, Gueritte F.
J Nat Prod (2011) 74 : 2081 -2088
PubMed 21939219 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 5.80 7.30
Inhibition 7 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1677 TACRINE HYDROCHLORIDE 4.0 1 7.30
CHEMBL1834806 1 5.85
CHEMBL1834808 EGONOL OLEATE 1 5.85
CHEMBL1834807 1 5.70
CHEMBL1834809 1 5.66
CHEMBL1834877 1 5.48
CHEMBL1834810 1 5.32
CHEMBL1834811 1 5.26
CHEMBL1834812 1 -
CHEMBL1834813 EGONOLPROPANOATE 1 -
CHEMBL1667984 EGONOL ACETATE 1 -
CHEMBL470982 DEMETHOXYEGONOL 1 -
CHEMBL470981 EGONOL 1 -
CHEMBL449127 1 -
CHEMBL1667991 EGONOIC ACID 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1677 TACRINE HYDROCHLORIDE IC50 = 50.0 nM 7.30
CHEMBL1834806 IC50 = 1400.0 nM 5.85
CHEMBL1834808 EGONOL OLEATE IC50 = 1400.0 nM 5.85
CHEMBL1834807 IC50 = 2000.0 nM 5.70
CHEMBL1834809 IC50 = 2200.0 nM 5.66
CHEMBL1834877 IC50 = 3300.0 nM 5.48
CHEMBL1834810 IC50 = 4800.0 nM 5.32
CHEMBL1834811 IC50 = 5500.0 nM 5.26
CHEMBL1834812 Inhibition - % -
CHEMBL1834813 EGONOLPROPANOATE Inhibition - % -
CHEMBL1667984 EGONOL ACETATE Inhibition - % -
CHEMBL470982 DEMETHOXYEGONOL Inhibition - % -
CHEMBL470981 EGONOL Inhibition - % -
CHEMBL449127 Inhibition - % -
CHEMBL1667991 EGONOIC ACID Inhibition - % -