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Assay Detail

CHEMBL906816

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

Binding
Inhibition of human BChE by Ellman's 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 Intermediate

Target

Cholinesterase (CHEMBL1914)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Synthesis, in vitro assay, and molecular modeling of new piperidine derivatives having dual inhibitory potency against acetylcholinesterase and Abeta1-42 aggregation for Alzheimer's disease therapeutics.
Kwon YE, Park JY, No KT, Shin JH, Lee SK, Eun JS, Yang JH, Shin TY, Kim DK, Chae BS, Leem JY, Kim KH.
Bioorg Med Chem (2007) 15 : 6596 -6607
PubMed 17681794 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 22 5.21 7.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL95 TACRINE 4.0 1 7.52
CHEMBL228360 1 6.60
CHEMBL229105 1 6.25
CHEMBL228361 1 6.11
CHEMBL389049 1 5.87
CHEMBL228359 1 5.80
CHEMBL228950 1 5.72
CHEMBL389048 1 5.45
CHEMBL228301 1 5.28
CHEMBL502 DONEPEZIL 4.0 1 5.00
CHEMBL228303 1 4.97
CHEMBL389047 1 4.87
CHEMBL228302 1 4.82
CHEMBL426915 1 4.80
CHEMBL229001 1 4.65
CHEMBL229051 1 4.63
CHEMBL390809 1 4.57
CHEMBL228999 1 4.50
CHEMBL229104 1 4.50
CHEMBL229000 1 4.42
CHEMBL229052 1 4.24
CHEMBL229050 1 4.10

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL95 TACRINE IC50 = 30.0 nM 7.52
CHEMBL228360 IC50 = 250.0 nM 6.60
CHEMBL229105 IC50 = 560.0 nM 6.25
CHEMBL228361 IC50 = 780.0 nM 6.11
CHEMBL389049 IC50 = 1350.0 nM 5.87
CHEMBL228359 IC50 = 1580.0 nM 5.80
CHEMBL228950 IC50 = 1890.0 nM 5.72
CHEMBL389048 IC50 = 3520.0 nM 5.45
CHEMBL228301 IC50 = 5230.0 nM 5.28
CHEMBL502 DONEPEZIL IC50 = 10050.0 nM 5.00
CHEMBL228303 IC50 = 10790.0 nM 4.97
CHEMBL389047 IC50 = 13650.0 nM 4.87
CHEMBL228302 IC50 = 15230.0 nM 4.82
CHEMBL426915 IC50 = 15670.0 nM 4.80
CHEMBL229001 IC50 = 22190.0 nM 4.65
CHEMBL229051 IC50 = 23210.0 nM 4.63
CHEMBL390809 IC50 = 26830.0 nM 4.57
CHEMBL228999 IC50 = 31550.0 nM 4.50
CHEMBL229104 IC50 = 31550.0 nM 4.50
CHEMBL229000 IC50 = 38400.0 nM 4.42
CHEMBL229052 IC50 = 57870.0 nM 4.24
CHEMBL229050 IC50 = 78920.0 nM 4.10