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Assay Detail

CHEMBL5371296

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

Binding
Inhibition of Electrophorus electricus AChE using ATCI as substrate pre-incubated for 10 mins followed by substrate addition measured after 5 mins by microplate reader analysis
15
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Electrophorus electricus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Acetylcholinesterase (CHEMBL4078)
Type SINGLE PROTEIN
Organism Electrophorus electricus

Publication

Aporphines: A privileged scaffold in CNS drug discovery.
Zhu R, Jiang G, Tang W, Zhao X, Chen F, Zhang X, Ye N.
Eur J Med Chem (2023) 256 : 115414 -115414
PubMed 37172474 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 15 5.14 5.96

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL456942 DEHYDRODICENTRINE 1 5.96
CHEMBL1171263 DEHYDROROEMERINE 1 5.92
CHEMBL5440844 1 5.54
CHEMBL5398483 1 5.37
CHEMBL464748 DICENTRINE 1 5.21
CHEMBL5430132 1 5.21
CHEMBL483825 1 5.08
CHEMBL1989287 1 4.98
CHEMBL601020 STEPHANINE 1 4.95
CHEMBL510954 1 4.92
CHEMBL1617041 1 4.75
CHEMBL5437306 1 4.49
CHEMBL5414111 1 4.40
CHEMBL469423 (-)-ASIMILOBINE 1 -
CHEMBL5433445 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL456942 DEHYDRODICENTRINE IC50 = 1090.0 nM 5.96
CHEMBL1171263 DEHYDROROEMERINE IC50 = 1210.0 nM 5.92
CHEMBL5440844 IC50 = 2850.0 nM 5.54
CHEMBL5398483 IC50 = 4300.0 nM 5.37
CHEMBL464748 DICENTRINE IC50 = 6110.0 nM 5.21
CHEMBL5430132 IC50 = 6120.0 nM 5.21
CHEMBL483825 IC50 = 8320.0 nM 5.08
CHEMBL1989287 IC50 = 10510.0 nM 4.98
CHEMBL601020 STEPHANINE IC50 = 11340.0 nM 4.95
CHEMBL510954 IC50 = 11940.0 nM 4.92
CHEMBL1617041 IC50 = 17630.0 nM 4.75
CHEMBL5437306 IC50 = 32490.0 nM 4.49
CHEMBL5414111 IC50 = 39800.0 nM 4.40
CHEMBL469423 (-)-ASIMILOBINE IC50 = 141470.0 nM -
CHEMBL5433445 IC50 = 147180.0 nM -