BDBM372862 US10246429, Example 269

SMILES COC[C@]12C[C@H]1[C@](C)(N=C(N)S2)c1cc(\C=C(/F)c2cnc(OCCF)cn2)ccc1F

InChI Key InChIKey=MWWSBMQBTHUTEH-UHFFFAOYSA-N

Data  3 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
Find this compound or compounds like it in BindingDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 3 hits for monomerid = 372862   

TargetBeta-secretase 1(Human)
Amgen

US Patent
LigandPNGBDBM372862(US10246429, Example 269)
Affinity DataIC50: 839nMAssay Description:The cDNAs for both human recombinant BACE1 and 2 with C-terminal 6-His Tags were cloned into transient protein expression vectors, which were subsequ...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2019
Entry Details
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TargetBeta-secretase 2(Human)
Amgen

US Patent
LigandPNGBDBM372862(US10246429, Example 269)
Affinity DataIC50: 1.14E+3nMMore data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2019
Entry Details
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TargetCathepsin D(Human)
Amgen

US Patent
LigandPNGBDBM372862(US10246429, Example 269)
Affinity DataIC50: 3.29E+5nMAssay Description:Recombinant Cat D was expressed in CHO cells. The assay buffer for CatD is 0.05M citrate pH 3.5, 10% DMSO final, 5 mM CHAPS. The CatD enzyme (9 nM) i...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/30/2019
Entry Details
Go to US Patent