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Assay Detail

CHEMBL3387411

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

Binding
Inhibition of human recombinant AChE after 5 mins by Ellman method
22
Total Activities
22
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Acetylcholinesterase (CHEMBL220)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Multitarget drug design strategy: quinone-tacrine hybrids designed to block amyloid-β aggregation and to exert anticholinesterase and antioxidant effects.
Nepovimova E, Uliassi E, Korabecny J, Peña-Altamira LE, Samez S, Pesaresi A, Garcia GE, Bartolini M, Andrisano V, Bergamini C, Fato R, Lamba D, Roberti M, Kuca K, Monti B, Bolognesi ML.
J Med Chem (2014) 57 : 8576 -8589
PubMed 25259726 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 7.20 9.14

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3356536 1 9.14
CHEMBL231160 MEMOQUIN 1 8.81
CHEMBL3356532 1 8.71
CHEMBL3356951 1 8.49
CHEMBL3356533 1 8.27
CHEMBL292314 1 8.14
CHEMBL3356952 1 8.05
CHEMBL3356537 1 8.03
CHEMBL3356530 1 7.84
CHEMBL3356534 1 7.61
CHEMBL3356954 1 7.42
CHEMBL3356531 1 7.27
CHEMBL3356953 1 7.02
CHEMBL3356535 1 6.99
CHEMBL3356539 1 6.46
CHEMBL95 TACRINE 4.0 1 6.30
CHEMBL3356538 1 6.19
CHEMBL3356950 1 6.09
CHEMBL3356540 1 5.86
CHEMBL3356528 1 5.60
CHEMBL3356529 1 5.21
CHEMBL1256415 1 4.98

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3356536 IC50 = 0.72 nM 9.14
CHEMBL231160 MEMOQUIN IC50 = 1.55 nM 8.81
CHEMBL3356532 IC50 = 1.93 nM 8.71
CHEMBL3356951 IC50 = 3.21 nM 8.49
CHEMBL3356533 IC50 = 5.4 nM 8.27
CHEMBL292314 IC50 = 7.18 nM 8.14
CHEMBL3356952 IC50 = 8.94 nM 8.05
CHEMBL3356537 IC50 = 9.24 nM 8.03
CHEMBL3356530 IC50 = 14.3 nM 7.84
CHEMBL3356534 IC50 = 24.7 nM 7.61
CHEMBL3356954 IC50 = 38.0 nM 7.42
CHEMBL3356531 IC50 = 53.7 nM 7.27
CHEMBL3356953 IC50 = 96.1 nM 7.02
CHEMBL3356535 IC50 = 103.0 nM 6.99
CHEMBL3356539 IC50 = 348.0 nM 6.46
CHEMBL95 TACRINE IC50 = 500.0 nM 6.30
CHEMBL3356538 IC50 = 651.0 nM 6.19
CHEMBL3356950 IC50 = 809.0 nM 6.09
CHEMBL3356540 IC50 = 1370.0 nM 5.86
CHEMBL3356528 IC50 = 2530.0 nM 5.60
CHEMBL3356529 IC50 = 6150.0 nM 5.21
CHEMBL1256415 IC50 = 10500.0 nM 4.98