BDBM68941 MLS000566826::N-Cyclohexyl-2-[{2-[(4-fluoro-phenylcarbamoyl)-methanesulfinyl]-acetyl}-(3-methoxy-phenyl)-amino]-2-thiophen-2-yl-acetamide::N-cyclohexyl-2-(N-[2-[2-(4-fluoroanilino)-2-keto-ethyl]sulfinylacetyl]-3-methoxy-anilino)-2-(2-thienyl)acetamide::N-cyclohexyl-2-(N-[2-[2-(4-fluoroanilino)-2-oxoethyl]sulfinyl-1-oxoethyl]-3-methoxyanilino)-2-thiophen-2-ylacetamide::N-cyclohexyl-2-(N-[2-[2-(4-fluoroanilino)-2-oxoethyl]sulfinylacetyl]-3-methoxyanilino)-2-thiophen-2-ylacetamide::N-cyclohexyl-2-[2-[2-[(4-fluorophenyl)amino]-2-oxidanylidene-ethyl]sulfinylethanoyl-(3-methoxyphenyl)amino]-2-thiophen-2-yl-ethanamide::SMR000172661::cid_3178116

SMILES COc1cccc(c1)N(C(C(=O)NC1CCCCC1)c1cccs1)C(=O)CS(=O)CC(=O)Nc1ccc(F)cc1

InChI Key InChIKey=MRMXEMBBQPMFSD-UHFFFAOYSA-N

Data  1 EC50

  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 1 hit for monomerid = 68941   

TargetGlycogen synthase kinase-3 beta(Human)
Broad Institute

Curated by PubChem BioAssay
LigandPNGBDBM68941(MLS000566826 | N-cyclohexyl-2-(N-[2-[2-(4-fluoroan...)
Affinity DataEC50: >3.00E+5nMAssay Description:Keywords: GSK3beta, dose response, kinase, inhibition, HTS Assay Overview: The glycogen synthase kinase-3 beta (GSK-3b) is a known master regulator f...More data for this Ligand-Target Pair
In Depth
Date in BDB:
7/29/2011
Entry Details
PCBioAssay