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Assay Detail

CHEMBL1769751

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

Binding
Inhibition of equine BChE incubated with compounf for 5 mins before addition of substrate S-butyrylthiocholine iodide by Ellman's method
36
Total Activities
36
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

Butyrylcholinesterase (CHEMBL5077)
Type SINGLE PROTEIN
Organism Equus caballus

Publication

Design, synthesis and structure-activity relationship (SAR) studies of 2,4-disubstituted pyrimidine derivatives: dual activity as cholinesterase and Aβ-aggregation inhibitors.
Mohamed T, Zhao X, Habib LK, Yang J, Rao PP.
Bioorg Med Chem (2011) 19 : 2269 -2281
PubMed 21429752 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 36 5.24 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL32823 1 8.00
CHEMBL1677 TACRINE HYDROCHLORIDE 4.0 1 7.72
CHEMBL1766151 1 5.66
CHEMBL1084213 1 5.58
CHEMBL1082977 1 5.47
CHEMBL1766019 1 5.47
CHEMBL1678 DONEPEZIL HYDROCHLORIDE 4.0 1 5.44
CHEMBL1086014 1 5.21
CHEMBL1766020 1 5.19
CHEMBL1766144 1 5.14
CHEMBL1766018 1 5.12
CHEMBL1766146 1 5.09
CHEMBL1084210 1 5.05
CHEMBL1766142 1 4.97
CHEMBL1555 GALANTAMINE HYDROBROMIDE 4.0 1 4.90
CHEMBL1082978 1 4.86
CHEMBL1766143 1 4.84
CHEMBL1082981 1 4.75
CHEMBL1085780 1 4.58
CHEMBL1084211 1 4.55
CHEMBL1084212 1 4.46
CHEMBL1766139 1 4.22
CHEMBL1085781 1 4.17
CHEMBL1082979 1 -
CHEMBL1766141 1 -
CHEMBL1766140 1 -
CHEMBL1766149 1 -
CHEMBL1082980 1 -
CHEMBL1085505 1 -
CHEMBL1766150 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL32823 IC50 = 10.0 nM 8.00
CHEMBL1677 TACRINE HYDROCHLORIDE IC50 = 19.0 nM 7.72
CHEMBL1766151 IC50 = 2200.0 nM 5.66
CHEMBL1084213 IC50 = 2600.0 nM 5.58
CHEMBL1082977 IC50 = 3400.0 nM 5.47
CHEMBL1766019 IC50 = 3400.0 nM 5.47
CHEMBL1678 DONEPEZIL HYDROCHLORIDE IC50 = 3600.0 nM 5.44
CHEMBL1086014 IC50 = 6100.0 nM 5.21
CHEMBL1766020 IC50 = 6500.0 nM 5.19
CHEMBL1766144 IC50 = 7300.0 nM 5.14
CHEMBL1766018 IC50 = 7600.0 nM 5.12
CHEMBL1766146 IC50 = 8200.0 nM 5.09
CHEMBL1084210 IC50 = 8900.0 nM 5.05
CHEMBL1766142 IC50 = 10700.0 nM 4.97
CHEMBL1555 GALANTAMINE HYDROBROMIDE IC50 = 12600.0 nM 4.90
CHEMBL1082978 IC50 = 13800.0 nM 4.86
CHEMBL1766143 IC50 = 14300.0 nM 4.84
CHEMBL1082981 IC50 = 17700.0 nM 4.75
CHEMBL1085780 IC50 = 26400.0 nM 4.58
CHEMBL1084211 IC50 = 28000.0 nM 4.55
CHEMBL1084212 IC50 = 34700.0 nM 4.46
CHEMBL1766139 IC50 = 59900.0 nM 4.22
CHEMBL1085781 IC50 = 68300.0 nM 4.17
CHEMBL1766148 IC50 > 100000.0 nM -
CHEMBL1766147 IC50 > 100000.0 nM -
CHEMBL1084808 IC50 > 100000.0 nM -
CHEMBL1766145 IC50 > 100000.0 nM -
CHEMBL1766016 IC50 > 100000.0 nM -
CHEMBL1766017 IC50 > 100000.0 nM -
CHEMBL1766150 IC50 > 100000.0 nM -
CHEMBL1085505 IC50 > 100000.0 nM -
CHEMBL1082980 IC50 > 100000.0 nM -
CHEMBL1766149 IC50 > 100000.0 nM -
CHEMBL1766140 IC50 > 100000.0 nM -
CHEMBL1766141 IC50 > 100000.0 nM -
CHEMBL1082979 IC50 > 100000.0 nM -