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Assay Detail

CHEMBL3239778

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

Binding
Inhibition of electric eel acetylcholinesterase using acetylthiocholine iodide as substrate preincubated for 10 mins before substrate addition after 15 mins by Ellman's method
23
Total Activities
23
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

Synthesis, crystal structure and biological evaluation of some novel 1,2,4-triazolo[3,4-b]-1,3,4-thiadiazoles and 1,2,4-triazolo[3,4-b]-1,3,4-thiadiazines.
Khan I, Zaib S, Ibrar A, Rama NH, Simpson J, Iqbal J.
Eur J Med Chem (2014) 78 : 167 -177
PubMed 24681981 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 19 4.91 7.52
Inhibition 4 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL502 DONEPEZIL 4.0 1 7.52
CHEMBL3237541 1 6.11
CHEMBL3237537 1 5.46
CHEMBL3237533 1 4.91
CHEMBL3237782 1 4.87
CHEMBL571510 1 4.87
CHEMBL278020 NEOSTIGMINE 4.0 1 4.85
CHEMBL3237539 1 4.81
CHEMBL3237781 1 4.79
CHEMBL3237779 1 4.73
CHEMBL3237531 1 4.67
CHEMBL3237778 1 4.64
CHEMBL3237777 1 4.62
CHEMBL3237783 1 4.55
CHEMBL3237532 1 4.52
CHEMBL3237542 1 4.43
CHEMBL3237540 1 4.38
CHEMBL3237535 1 4.29
CHEMBL3237538 1 4.27
CHEMBL3237780 1 -
CHEMBL3237536 1 -
CHEMBL3237784 1 -
CHEMBL3237534 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL502 DONEPEZIL IC50 = 30.0 nM 7.52
CHEMBL3237541 IC50 = 770.0 nM 6.11
CHEMBL3237537 IC50 = 3480.0 nM 5.46
CHEMBL3237533 IC50 = 12400.0 nM 4.91
CHEMBL3237782 IC50 = 13660.0 nM 4.87
CHEMBL571510 IC50 = 13460.0 nM 4.87
CHEMBL278020 NEOSTIGMINE IC50 = 14200.0 nM 4.85
CHEMBL3237539 IC50 = 15640.0 nM 4.81
CHEMBL3237781 IC50 = 16110.0 nM 4.79
CHEMBL3237779 IC50 = 18600.0 nM 4.73
CHEMBL3237531 IC50 = 21260.0 nM 4.67
CHEMBL3237778 IC50 = 22740.0 nM 4.64
CHEMBL3237777 IC50 = 23800.0 nM 4.62
CHEMBL3237783 IC50 = 28030.0 nM 4.55
CHEMBL3237532 IC50 = 30190.0 nM 4.52
CHEMBL3237542 IC50 = 36840.0 nM 4.43
CHEMBL3237540 IC50 = 41480.0 nM 4.38
CHEMBL3237535 IC50 = 51180.0 nM 4.29
CHEMBL3237538 IC50 = 54050.0 nM 4.27
CHEMBL3237780 Inhibition = 46.09 % -
CHEMBL3237536 Inhibition = 47.2 % -
CHEMBL3237784 Inhibition = 45.99 % -
CHEMBL3237534 Inhibition = 34.63 % -