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Assay Detail

CHEMBL4023573

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

Binding
Inhibition of equine BChE using BTC iodide as substrate preincubated for 4.5 mins followed by substrate addition measured after 2.5 mins by Ellman's method
4
Total Activities
4
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Equus caballus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Cholinesterase (CHEMBL5763)
Type SINGLE PROTEIN
Organism Equus caballus

Publication

Structure-Activity Relationships and Computational Investigations into the Development of Potent and Balanced Dual-Acting Butyrylcholinesterase Inhibitors and Human Cannabinoid Receptor 2 Ligands with Pro-Cognitive in Vivo Profiles.
Dolles D, Hoffmann M, Gunesch S, Marinelli O, Möller J, Santoni G, Chatonnet A, Lohse MJ, Wittmann HJ, Strasser A, Nabissi M, Maurice T, Decker M.
J Med Chem (2018) 61 : 1646 -1663
PubMed 29400965 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 4 5.56 6.16

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL4079520 1 6.16
CHEMBL4082936 1 5.64
CHEMBL4100917 1 5.43
CHEMBL471980 1 5.01

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL4079520 IC50 = 700.0 nM 6.16
CHEMBL4082936 IC50 = 2300.0 nM 5.64
CHEMBL4100917 IC50 = 3700.0 nM 5.43
CHEMBL471980 IC50 = 9700.0 nM 5.01