BDBM199099 US9221839, 4a

SMILES COc1cnc(cn1)C(=O)Nc1ccc(F)c(c1)[C@@]12COC[C@@H]1S(=O)(=O)N(C)C(=N)N2

InChI Key InChIKey=XPCOWTWHHNDBJU-KSSFIOAISA-N

Data  2 KI

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 2 hits for monomerid = 199099   

TargetBeta-secretase 1(Homo sapiens (Human))
Merck Sharp & Dohme

US Patent
LigandPNGBDBM199099(US9221839, 4a)
Affinity DataKi:  1.33E+3nM ΔG°:  -8.15kcal/molepH: 5.0 T: 2°CAssay Description:A homogeneous time-resolved FRET assay can be used to determine IC50 values for inhibitors of the soluble human BACE1 catalytic domain. This assay ...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent
TargetBeta-secretase 2(Homo sapiens (Human))
Merck Sharp & Dohme

US Patent
LigandPNGBDBM199099(US9221839, 4a)
Affinity DataKi:  1.51E+3nM ΔG°:  -8.07kcal/molepH: 5.0 T: 2°CAssay Description:Inhibitor IC50s at purified human autoBACE-2 are determined in a time-resolved endpoint proteolysis assay that measures hydrolysis of the QSY7-EISE...More data for this Ligand-Target Pair
Ligand InfoPC cidPC sid
In DepthDetails US Patent