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Assay Detail

CHEMBL829159

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Binding
In vitro inhibitory activity against human erythrocyte acetylcholinesterase
12
Total Activities
12
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Expert

Target

Acetylcholinesterase (CHEMBL220)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Modulation of binding strength in several classes of active site inhibitors of acetylcholinesterase studied by comparative binding energy analysis.
Martín-Santamaría S, Muñoz-Muriedas J, Luque FJ, Gago F.
J Med Chem (2004) 47 : 4471 -4482
PubMed 15317459 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 12 7.34 8.74

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL292314 1 8.74
CHEMBL352500 1 8.35
CHEMBL134057 1 8.03
CHEMBL1161714 1 7.54
CHEMBL431844 1 7.50
CHEMBL95 TACRINE 4.0 1 7.47
CHEMBL368196 1 7.37
CHEMBL369661 1 7.16
CHEMBL355740 1 7.07
CHEMBL1161715 1 6.79
CHEMBL62084 1 6.13
CHEMBL172118 1 5.96

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL292314 IC50 = 1.82 nM 8.74
CHEMBL352500 IC50 = 4.467 nM 8.35
CHEMBL134057 IC50 = 9.333 nM 8.03
CHEMBL1161714 IC50 = 28.84 nM 7.54
CHEMBL431844 IC50 = 31.62 nM 7.50
CHEMBL95 TACRINE IC50 = 33.88 nM 7.47
CHEMBL368196 IC50 = 42.66 nM 7.37
CHEMBL369661 IC50 = 69.18 nM 7.16
CHEMBL355740 IC50 = 85.11 nM 7.07
CHEMBL1161715 IC50 = 162.18 nM 6.79
CHEMBL62084 IC50 = 741.31 nM 6.13
CHEMBL172118 IC50 = 1096.48 nM 5.96