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Assay Detail

CHEMBL641567

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Binding
Inhibition concentration against rat acetylcholinesterase
54
Total Activities
54
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

Acetylcholinesterase (CHEMBL3199)
Type SINGLE PROTEIN
Organism Rattus norvegicus

Publication

Docking analysis of a series of benzylamino acetylcholinesterase inhibitors with a phthalimide, benzoyl, or indanone moiety.
Yamamoto Y, Ishihara Y, Kuntz ID.
J Med Chem (1994) 37 : 3141 -3153
PubMed 7932538 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 54 6.61 9.42

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL106739 1 9.42
CHEMBL107316 1 8.28
CHEMBL110268 1 8.22
CHEMBL108726 1 8.11
CHEMBL322392 1 8.00
CHEMBL311017 1 8.00
CHEMBL308793 1 7.96
CHEMBL105874 1 7.89
CHEMBL75110 1 7.70
CHEMBL107572 1 7.70
CHEMBL74560 1 7.66
CHEMBL319003 1 7.62
CHEMBL320636 1 7.62
CHEMBL110627 1 7.55
CHEMBL106891 1 7.52
CHEMBL108369 1 7.35
CHEMBL110554 1 7.30
CHEMBL108632 1 7.28
CHEMBL73637 1 7.17
CHEMBL107208 1 7.12
CHEMBL74747 1 7.09
CHEMBL75013 ZANAPEZIL 2.0 1 7.01
CHEMBL418807 1 7.00
CHEMBL322393 1 6.82
CHEMBL110244 1 6.79
CHEMBL107263 1 6.66
CHEMBL105825 1 6.60
CHEMBL322328 1 6.57
CHEMBL107110 1 6.56
CHEMBL106574 1 6.52

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL106739 IC50 = 0.38 nM 9.42
CHEMBL107316 IC50 = 5.3 nM 8.28
CHEMBL110268 IC50 = 6.0 nM 8.22
CHEMBL108726 IC50 = 7.7 nM 8.11
CHEMBL322392 IC50 = 10.0 nM 8.00
CHEMBL311017 IC50 = 10.0 nM 8.00
CHEMBL308793 IC50 = 11.0 nM 7.96
CHEMBL105874 IC50 = 13.0 nM 7.89
CHEMBL75110 IC50 = 20.0 nM 7.70
CHEMBL107572 IC50 = 20.0 nM 7.70
CHEMBL74560 IC50 = 22.0 nM 7.66
CHEMBL319003 IC50 = 24.0 nM 7.62
CHEMBL320636 IC50 = 24.0 nM 7.62
CHEMBL110627 IC50 = 28.0 nM 7.55
CHEMBL106891 IC50 = 30.0 nM 7.52
CHEMBL108369 IC50 = 45.0 nM 7.35
CHEMBL110554 IC50 = 50.0 nM 7.30
CHEMBL108632 IC50 = 52.0 nM 7.28
CHEMBL73637 IC50 = 68.0 nM 7.17
CHEMBL107208 IC50 = 76.0 nM 7.12
CHEMBL74747 IC50 = 81.0 nM 7.09
CHEMBL75013 ZANAPEZIL IC50 = 98.0 nM 7.01
CHEMBL418807 IC50 = 100.0 nM 7.00
CHEMBL322393 IC50 = 151.0 nM 6.82
CHEMBL110244 IC50 = 161.0 nM 6.79
CHEMBL107263 IC50 = 220.0 nM 6.66
CHEMBL105825 IC50 = 252.0 nM 6.60
CHEMBL322328 IC50 = 269.0 nM 6.57
CHEMBL107110 IC50 = 274.0 nM 6.56
CHEMBL106574 IC50 = 305.0 nM 6.52
CHEMBL310467 IC50 = 376.0 nM 6.42
CHEMBL320730 IC50 = 474.0 nM 6.32
CHEMBL105932 IC50 = 539.0 nM 6.27
CHEMBL110723 IC50 = 607.0 nM 6.22
CHEMBL110281 IC50 = 770.0 nM 6.11
CHEMBL108356 IC50 = 920.0 nM 6.04
CHEMBL107149 IC50 = 1070.0 nM 5.97
CHEMBL108231 IC50 = 1090.0 nM 5.96
CHEMBL307513 IC50 = 1330.0 nM 5.88
CHEMBL104005 IC50 = 1360.0 nM 5.87
CHEMBL106528 IC50 = 1900.0 nM 5.72
CHEMBL108525 IC50 = 2300.0 nM 5.64
CHEMBL432023 IC50 = 2650.0 nM 5.58
CHEMBL326868 IC50 = 3000.0 nM 5.52
CHEMBL108171 IC50 = 3000.0 nM 5.52
CHEMBL74962 IC50 = 3140.0 nM 5.50
CHEMBL110298 IC50 = 3370.0 nM 5.47
CHEMBL106582 IC50 = 5320.0 nM 5.27
CHEMBL106678 IC50 = 8230.0 nM 5.08
CHEMBL106766 IC50 = 11800.0 nM 4.93