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Compile Data Set for Download or QSAR
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
(change energy unit to
kcal/mol
)
Found
3
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Target
Beta-secretase 1 [1-458]
(Homo sapiens (Human))
Vitae Pharmaceuticals
US Patent
Ligand
BDBM195484
(US9212153, 332,Ex. 281)
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Affinity Data
IC50: 34.9nM
pH: 4.4
Assay Description:
For each compound being tested, the BACE activity was monitored in a fluorescence quenching assay (FRET) using the ectodomain of BACE (aa 1-454) fuse...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
UniProtKB/SwissProt
B.MOAD
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
US Patent
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Target
Beta-secretase 1 [1-454]
(Homo sapiens (Human))
Vitae Pharmaceutical
US Patent
Ligand
BDBM259485
(US9526727, Comparison Example Table 2, 2''-amino-4...)
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Affinity Data
IC50: 35nM
pH: 4.4
Assay Description:
The inhibitory activity of compounds was assessed by a fluorescence quench assay of BACE1 activity using commercially available substrate HiLyte Fluo...
More data for this Ligand-Target Pair
Target Info
PDB
UniProtKB/SwissProt
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
US Patent
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Target
Potassium voltage-gated channel subfamily H member 2
(Homo sapiens (Human))
Vitae Pharmaceutical
US Patent
Ligand
BDBM259485
(US9526727, Comparison Example Table 2, 2''-amino-4...)
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Affinity Data
IC50: 1.00E+4nM
pH: 7.4 T: 2°C
Assay Description:
Cells were superfused with a bath solution containing (mM): NaCl (137), KCl (4.0), MgCl2 (1.0), CaCl2 (1.8), Glucose (10), HEPES (10), pH 7.4 with Na...
More data for this Ligand-Target Pair
Target Info
PDB
MMDB
Reactome pathway
KEGG
UniProtKB/SwissProt
UniProtKB/TrEMBL
B.MOAD
DrugBank
antibodypedia
GoogleScholar
Ligand Info
PC cid
PC sid
In Depth
Details
US Patent
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