BDBM13446 Tetrahydroisoquinoline (TIQ) deriv. 8m::ammonium N-[(3S)-2-[(2E)-3-(1-benzofuran-3-yl)prop-2-enoyl]-3-(methylcarbamoyl)-1,2,3,4-tetrahydroisoquinolin-7-yl]sulfamate

SMILES CNC(=O)[C@@H]1Cc2ccc(NS([O-])(=O)=O)cc2CN1C(=O)C=Cc1coc2ccccc12

InChI Key InChIKey=CXWSVQYERIQFRA-UHFFFAOYSA-M

Data  1 IC50

  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 = 13446   

TargetTyrosine-protein phosphatase non-receptor type 1 [1-298](Human)
Procter & Gamble Pharmaceuticals

LigandPNGBDBM13446(ammonium N-[(3S)-2-[(2E)-3-(1-benzofuran-3-yl)prop...)
Affinity DataIC50: 2.49E+4nMpH: 7.0 T: 2°CAssay Description:The activity of PTP1B enzyme was assayed with DiFMUP as substrate. Hydrolysis of substrate was monitored on a Victor V plate reader (Wallac). Kinetic...More data for this Ligand-Target Pair
In Depth
Date in BDB:
1/29/2007
Entry Details Article
PubMed