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Assay Detail

CHEMBL3758061

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

Binding
Inhibition of recombinant human AChE using acetylthiocholine iodide as substrate preincubated for 20 mins followed by substrate addition by Ellman's method
28
Total Activities
28
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

Novel Tacrine-Benzofuran Hybrids as Potent Multitarget-Directed Ligands for the Treatment of Alzheimer's Disease: Design, Synthesis, Biological Evaluation, and X-ray Crystallography.
Zha X, Lamba D, Zhang L, Lou Y, Xu C, Kang D, Chen L, Xu Y, Zhang L, De Simone A, Samez S, Pesaresi A, Stojan J, Lopez MG, Egea J, Andrisano V, Bartolini M.
J Med Chem (2016) 59 : 114 -131
PubMed 26632651 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 28 6.94 9.09

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3752685 1 9.09
CHEMBL3752467 1 9.07
CHEMBL3753405 1 8.59
CHEMBL3752543 1 7.97
CHEMBL3752969 1 7.82
CHEMBL3753850 1 7.61
CHEMBL3752119 1 7.49
CHEMBL3752926 1 7.36
CHEMBL3751941 1 7.33
CHEMBL3754291 1 7.31
CHEMBL3752356 1 7.20
CHEMBL3751866 1 7.11
CHEMBL3753360 1 6.93
CHEMBL3754005 1 6.70
CHEMBL3754672 1 6.70
CHEMBL3752384 1 6.65
CHEMBL3753957 1 6.58
CHEMBL3753706 1 6.51
CHEMBL3754480 1 6.49
CHEMBL3754146 1 6.38
CHEMBL95 TACRINE 4.0 1 6.37
CHEMBL3752451 1 6.37
CHEMBL3752555 1 6.26
CHEMBL3754739 1 6.00
CHEMBL3754778 1 5.99
CHEMBL3753508 1 5.77
CHEMBL3754341 1 5.68
CHEMBL3754694 1 5.12

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3752685 IC50 = 0.81 nM 9.09
CHEMBL3752467 IC50 = 0.86 nM 9.07
CHEMBL3753405 IC50 = 2.56 nM 8.59
CHEMBL3752543 IC50 = 10.8 nM 7.97
CHEMBL3752969 IC50 = 15.3 nM 7.82
CHEMBL3753850 IC50 = 24.4 nM 7.61
CHEMBL3752119 IC50 = 32.3 nM 7.49
CHEMBL3752926 IC50 = 44.2 nM 7.36
CHEMBL3751941 IC50 = 47.0 nM 7.33
CHEMBL3754291 IC50 = 48.6 nM 7.31
CHEMBL3752356 IC50 = 63.1 nM 7.20
CHEMBL3751866 IC50 = 76.9 nM 7.11
CHEMBL3753360 IC50 = 117.0 nM 6.93
CHEMBL3754005 IC50 = 199.0 nM 6.70
CHEMBL3754672 IC50 = 200.0 nM 6.70
CHEMBL3752384 IC50 = 222.0 nM 6.65
CHEMBL3753957 IC50 = 260.0 nM 6.58
CHEMBL3753706 IC50 = 308.0 nM 6.51
CHEMBL3754480 IC50 = 323.0 nM 6.49
CHEMBL3754146 IC50 = 416.0 nM 6.38
CHEMBL95 TACRINE IC50 = 424.0 nM 6.37
CHEMBL3752451 IC50 = 424.0 nM 6.37
CHEMBL3752555 IC50 = 545.0 nM 6.26
CHEMBL3754739 IC50 = 993.0 nM 6.00
CHEMBL3754778 IC50 = 1036.0 nM 5.99
CHEMBL3753508 IC50 = 1685.0 nM 5.77
CHEMBL3754341 IC50 = 2070.0 nM 5.68
CHEMBL3754694 IC50 = 7495.0 nM 5.12