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Assay Detail

CHEMBL2185582

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

Binding
Inhibition of BACE1 in human neuroblastoma cells
7
Total Activities
7
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

Structure-based design of highly selective β-secretase inhibitors: synthesis, biological evaluation, and protein-ligand X-ray crystal structure.
Ghosh AK, Venkateswara Rao K, Yadav ND, Anderson DD, Gavande N, Huang X, Terzyan S, Tang J.
J Med Chem (2012) 55 : 9195 -9207
PubMed 22954357 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 7 8.16 9.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2179131 1 9.00
CHEMBL403268 1 8.60
CHEMBL2179130 1 8.02
CHEMBL2179140 1 7.85
CHEMBL2179138 1 7.82
CHEMBL2179136 1 7.66
CHEMBL2179132 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2179131 IC50 = 1.0 nM 9.00
CHEMBL403268 IC50 = 2.5 nM 8.60
CHEMBL2179130 IC50 = 9.5 nM 8.02
CHEMBL2179140 IC50 = 14.0 nM 7.85
CHEMBL2179138 IC50 = 15.0 nM 7.82
CHEMBL2179136 IC50 = 22.0 nM 7.66
CHEMBL2179132 IC50 > 1000.0 nM -