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Assay Detail

CHEMBL637619

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

Binding
Inhibition of activity against Torpedo Ray acetylcholinesterase.
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Torpedo californica
Confidence 9 — Direct single protein target
Curated By Expert

Target

Acetylcholinesterase (CHEMBL4780)
Type SINGLE PROTEIN
Organism Torpedo californica

Publication

A structure-based design approach to the development of novel, reversible AChE inhibitors.
Doucet-Personeni C, Bentley PD, Fletcher RJ, Kinkaid A, Kryger G, Pirard B, Taylor A, Taylor R, Taylor J, Viner R, Silman I, Sussman JL, Greenblatt HM, Lewis T.
J Med Chem (2001) 44 : 3203 -3215
PubMed 11563919 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 20 6.82 8.62

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL107516 1 8.62
CHEMBL108313 1 8.52
CHEMBL108696 1 8.52
CHEMBL419926 1 8.42
CHEMBL108749 1 8.29
CHEMBL95 TACRINE 4.0 1 8.09
CHEMBL322994 1 7.92
CHEMBL109105 1 7.85
CHEMBL108434 1 7.75
CHEMBL107504 1 7.44
CHEMBL322727 1 6.44
CHEMBL108872 1 6.13
CHEMBL325142 1 5.72
CHEMBL323772 1 5.70
CHEMBL107931 1 5.58
CHEMBL321926 1 5.58
CHEMBL108143 1 5.14
CHEMBL325766 1 4.96
CHEMBL322791 1 4.85
CHEMBL109152 1 4.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL107516 IC50 = 2.4 nM 8.62
CHEMBL108313 IC50 = 3.0 nM 8.52
CHEMBL108696 IC50 = 3.0 nM 8.52
CHEMBL419926 IC50 = 3.8 nM 8.42
CHEMBL108749 IC50 = 5.1 nM 8.29
CHEMBL95 TACRINE IC50 = 8.2 nM 8.09
CHEMBL322994 IC50 = 12.0 nM 7.92
CHEMBL109105 IC50 = 14.0 nM 7.85
CHEMBL108434 IC50 = 18.0 nM 7.75
CHEMBL107504 IC50 = 36.0 nM 7.44
CHEMBL322727 IC50 = 360.0 nM 6.44
CHEMBL108872 IC50 = 740.0 nM 6.13
CHEMBL325142 IC50 = 1900.0 nM 5.72
CHEMBL323772 IC50 = 2000.0 nM 5.70
CHEMBL107931 IC50 = 2600.0 nM 5.58
CHEMBL321926 IC50 = 2600.0 nM 5.58
CHEMBL108143 IC50 = 7200.0 nM 5.14
CHEMBL325766 IC50 = 11000.0 nM 4.96
CHEMBL322791 IC50 = 14000.0 nM 4.85
CHEMBL109152 IC50 = 15000.0 nM 4.82