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Assay Detail

CHEMBL2014640

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

Binding
Binding affinity to BACE1 by surface plasmon resonance method
14
Total Activities
14
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

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

Publication

Fragment based drug discovery: practical implementation based on ¹⁹F NMR spectroscopy.
Jordan JB, Poppe L, Xia X, Cheng AC, Sun Y, Michelsen K, Eastwood H, Schnier PD, Nixey T, Zhong W.
J Med Chem (2012) 55 : 678 -687
PubMed 22165820 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Kd 14 3.40 4.60

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL1821803 1 4.60
CHEMBL1821802 1 4.47
CHEMBL2011277 1 4.41
CHEMBL2011278 1 3.70
CHEMBL2011271 1 3.52
CHEMBL1981917 1 3.49
CHEMBL61236 1 3.05
CHEMBL185917 1 2.89
CHEMBL2011275 1 2.89
CHEMBL361660 1 2.80
CHEMBL2011276 1 2.54
CHEMBL2011274 1 2.41
CHEMBL2011272 1 -
CHEMBL2011273 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL1821803 Kd = 25000.0 nM 4.60
CHEMBL1821802 Kd = 34000.0 nM 4.47
CHEMBL2011277 Kd = 39000.0 nM 4.41
CHEMBL2011278 Kd = 200000.0 nM 3.70
CHEMBL2011271 Kd = 300000.0 nM 3.52
CHEMBL1981917 Kd = 325000.0 nM 3.49
CHEMBL61236 Kd = 900000.0 nM 3.05
CHEMBL185917 Kd = 1280000.0 nM 2.89
CHEMBL2011275 Kd = 1300000.0 nM 2.89
CHEMBL361660 Kd = 1600000.0 nM 2.80
CHEMBL2011276 Kd = 2900000.0 nM 2.54
CHEMBL2011274 Kd = 3900000.0 nM 2.41
CHEMBL2011272 Kd > 2000000.0 nM -
CHEMBL2011273 Kd > 2000000.0 nM -