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Assay Detail

CHEMBL3293240

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Binding
Inhibition of BACE1 (unknown origin)
13
Total Activities
8
Compounds Tested
3
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

β-Secretase (BACE1)-inhibiting C-methylrotenoids from Abronia nana suspension cultures.
Park SH, Yang EJ, Kim SI, Song KS.
Bioorg Med Chem Lett (2014) 24 : 2945 -2948
PubMed 24835197 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 8 5.38 6.39
Inhibition 3 - -
Ki 2 5.23 5.29

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL506814 PUNICALAGIN 1 6.39
CHEMBL450745 EUGENIIN 2 5.51
CHEMBL382408 PENTAGALLOYL GLUCOSE 2 5.42
CHEMBL6246 ELLAGIC ACID 2.0 1 5.41
CHEMBL3287409 2 5.37
CHEMBL498456 BOERAVINONE D 2 5.32
CHEMBL3287407 2 4.21
CHEMBL3287408 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL506814 PUNICALAGIN IC50 = 410.0 nM 6.39
CHEMBL450745 EUGENIIN IC50 = 3100.0 nM 5.51
CHEMBL382408 PENTAGALLOYL GLUCOSE IC50 = 3760.0 nM 5.42
CHEMBL6246 ELLAGIC ACID IC50 = 3900.0 nM 5.41
CHEMBL3287409 IC50 = 4240.0 nM 5.37
CHEMBL498456 BOERAVINONE D IC50 = 4770.0 nM 5.32
CHEMBL382408 PENTAGALLOYL GLUCOSE Ki = 5130.0 nM 5.29
CHEMBL450745 EUGENIIN Ki = 6840.0 nM 5.17
CHEMBL3287407 IC50 = 62210.0 nM 4.21
CHEMBL3287408 IC50 > 3000000.0 nM -
CHEMBL498456 BOERAVINONE D Inhibition - % -
CHEMBL3287407 Inhibition - % -
CHEMBL3287409 Inhibition - % -