BDBM160539 US9040717, Compound (B)

SMILES Cn1cc(cn1)-c1cc(OCC(C)(C)O)cc2c1-c1ccccc1[C@]2(O)C(F)(F)F

InChI Key InChIKey=GREFSKGKKVFHGU-UHFFFAOYSA-N

Data  1 IC50

  Tab Delimited (TSV)   2D SDfile   Computed 3D by Vconf -m prep SDfile
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   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 160539   

LigandPNGBDBM160539(US9040717, Compound (B))
Affinity DataIC50: 7.40nMpH: 8.0 T: 2°CAssay Description:For expression of hPDHK2 activity, Escherichia coli strain BL21(DE3) cells (Novagen) were transformed with the pET17b vector containing modified hPDH...More data for this Ligand-Target Pair
In Depth
Date in BDB:
12/21/2015
Entry Details
US Patent