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Assay Detail

CHEMBL4821401

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

Binding
Inhibition of human erythrocyte AChE using acetylthiocholine iodide as substrate preincubated for 10 mins followed by substrate addition by Ellman's method
16
Total Activities
16
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 potent bifunctional carboxylesterase inhibitors based on a polyfluoroalkyl-2-imino-1,3-dione scaffold.
Makhaeva GF, Lushchekina SV, Boltneva NP, Serebryakova OG, Kovaleva NV, Rudakova EV, Elkina NA, Shchegolkov EV, Burgart YV, Stupina TS, Terentiev AA, Radchenko EV, Palyulin VA, Saloutin VI, Bachurin SO, Richardson RJ.
Eur J Med Chem (2021) 218 : 113385 -113385
PubMed 33831780 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 5.25 6.32

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4847987 1 6.32
CHEMBL4854298 1 6.12
CHEMBL4868014 1 5.87
CHEMBL4858186 1 5.57
CHEMBL4853742 1 5.49
CHEMBL4856140 1 5.42
CHEMBL4855755 1 5.33
CHEMBL4849361 1 5.13
CHEMBL4849436 1 4.70
CHEMBL4855838 1 4.68
CHEMBL4868687 1 4.55
CHEMBL4853637 1 4.52
CHEMBL4872772 1 4.52
CHEMBL153 TROLOX 1 -
CHEMBL196 ASCORBIC ACID 4.0 1 -
CHEMBL280998 CATECHOL 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4847987 IC50 = 481.0 nM 6.32
CHEMBL4854298 IC50 = 759.0 nM 6.12
CHEMBL4868014 IC50 = 1360.0 nM 5.87
CHEMBL4858186 IC50 = 2670.0 nM 5.57
CHEMBL4853742 IC50 = 3220.0 nM 5.49
CHEMBL4856140 IC50 = 3790.0 nM 5.42
CHEMBL4855755 IC50 = 4620.0 nM 5.33
CHEMBL4849361 IC50 = 7320.0 nM 5.13
CHEMBL4849436 IC50 = 20100.0 nM 4.70
CHEMBL4855838 IC50 = 20900.0 nM 4.68
CHEMBL4868687 IC50 = 28300.0 nM 4.55
CHEMBL4853637 IC50 = 30400.0 nM 4.52
CHEMBL4872772 IC50 = 30300.0 nM 4.52
CHEMBL153 TROLOX IC50 - -
CHEMBL196 ASCORBIC ACID IC50 - -
CHEMBL280998 CATECHOL IC50 - -