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Assay Detail

CHEMBL965675

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

Binding
Inhibition of rat AChE
10
Total Activities
8
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Rattus norvegicus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Acetylcholinesterase (CHEMBL3199)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Exploiting protein fluctuations at the active-site gorge of human cholinesterases: further optimization of the design strategy to develop extremely potent inhibitors.
Butini S, Campiani G, Borriello M, Gemma S, Panico A, Persico M, Catalanotti B, Ros S, Brindisi M, Agnusdei M, Fiorini I, Nacci V, Novellino E, Belinskaya T, Saxena A, Fattorusso C.
J Med Chem (2008) 51 : 3154 -3170
PubMed 18479118 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 9 7.70 8.82
Ki 1 7.71 7.71

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL258928 1 8.82
CHEMBL32823 1 8.82
CHEMBL76658 1 8.06
CHEMBL484705 1 8.06
CHEMBL519154 2 7.71
CHEMBL179732 1 7.55
CHEMBL395280 HUPERZINE A 2.0 2 6.94
CHEMBL483090 1 6.82

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL258928 IC50 = 1.5 nM 8.82
CHEMBL32823 IC50 = 1.5 nM 8.82
CHEMBL76658 IC50 = 8.8 nM 8.06
CHEMBL484705 IC50 = 8.8 nM 8.06
CHEMBL519154 Ki = 19.6 nM 7.71
CHEMBL179732 IC50 = 28.0 nM 7.55
CHEMBL519154 IC50 = 52.0 nM 7.28
CHEMBL395280 HUPERZINE A IC50 = 114.0 nM 6.94
CHEMBL395280 HUPERZINE A IC50 = 114.0 nM 6.94
CHEMBL483090 IC50 = 151.0 nM 6.82