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Assay Detail

CHEMBL1827653

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

Binding
Inhibition of human recombinant BACE1 after 60 mins by FRET assay
23
Total Activities
23
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Beta-secretase 1 (CHEMBL4822)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

From fragment screening to in vivo efficacy: optimization of a series of 2-aminoquinolines as potent inhibitors of beta-site amyloid precursor protein cleaving enzyme 1 (BACE1).
Cheng Y, Judd TC, Bartberger MD, Brown J, Chen K, Fremeau RT, Hickman D, Hitchcock SA, Jordan B, Li V, Lopez P, Louie SW, Luo Y, Michelsen K, Nixey T, Powers TS, Rattan C, Sickmier EA, St Jean DJ, Wahl RC, Wen PH, Wood S.
J Med Chem (2011) 54 : 5836 -5857
PubMed 21707077 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 23 7.58 9.19

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1821820 1 9.19
CHEMBL1821728 1 9.15
CHEMBL1821815 1 8.60
CHEMBL1821814 1 8.43
CHEMBL1821825 1 8.00
CHEMBL1821827 1 7.96
CHEMBL1821819 1 7.96
CHEMBL1821830 1 7.82
CHEMBL1821817 1 7.80
CHEMBL1821826 1 7.80
CHEMBL1821821 1 7.70
CHEMBL1821818 1 7.57
CHEMBL1821823 1 7.51
CHEMBL1821812 1 7.47
CHEMBL1821824 1 7.30
CHEMBL1821811 1 7.13
CHEMBL1821822 1 7.06
CHEMBL1821828 1 7.01
CHEMBL1821829 1 6.41
CHEMBL1821816 1 6.01
CHEMBL1821810 1 5.28
CHEMBL1821813 1 -
CHEMBL1821809 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1821820 IC50 = 0.65 nM 9.19
CHEMBL1821728 IC50 = 0.7 nM 9.15
CHEMBL1821815 IC50 = 2.5 nM 8.60
CHEMBL1821814 IC50 = 3.7 nM 8.43
CHEMBL1821825 IC50 = 10.0 nM 8.00
CHEMBL1821827 IC50 = 11.0 nM 7.96
CHEMBL1821819 IC50 = 11.0 nM 7.96
CHEMBL1821830 IC50 = 15.0 nM 7.82
CHEMBL1821817 IC50 = 16.0 nM 7.80
CHEMBL1821826 IC50 = 16.0 nM 7.80
CHEMBL1821821 IC50 = 20.0 nM 7.70
CHEMBL1821818 IC50 = 27.0 nM 7.57
CHEMBL1821823 IC50 = 31.0 nM 7.51
CHEMBL1821812 IC50 = 34.0 nM 7.47
CHEMBL1821824 IC50 = 50.0 nM 7.30
CHEMBL1821811 IC50 = 74.0 nM 7.13
CHEMBL1821822 IC50 = 88.0 nM 7.06
CHEMBL1821828 IC50 = 97.0 nM 7.01
CHEMBL1821829 IC50 = 390.0 nM 6.41
CHEMBL1821816 IC50 = 970.0 nM 6.01
CHEMBL1821810 IC50 = 5200.0 nM 5.28
CHEMBL1821813 IC50 - -
CHEMBL1821809 IC50 - -