BDBM511582 US11059794, Example 6.42::tert-butyl 4-[2-(2,3-difluoro-4- sulfamoylphenyl)sulfinylethyl]- piperidine-1-carboxylate (intermediate 10.6)/3-[4- (difluoromethoxy)-2-[(5- methyltetrazol-2- yl)methyl]phenyl]propanoic acid (intermediate 13.2)

SMILES Cc1nnn(Cc2cc(OC(F)F)ccc2CCC(=O)N2CCC(CCS(=O)c3ccc(c(F)c3F)S(N)(=O)=O)CC2)n1

InChI Key InChIKey=GEOBGFDHUGCISJ-UHFFFAOYSA-N

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 = 511582   

TargetAutotaxin(Human)
Hoffmann-La Roche

US Patent
LigandPNGBDBM511582(tert-butyl 4-[2-(2,3-difluoro-4- sulfamoylphenyl)s...)
Affinity DataIC50: 3nMAssay Description:ATX inhibition was measured by a fluorescence quenching assay using a specifically labeled substrate analogue (MR121 substrate). To obtain this MR121...More data for this Ligand-Target Pair
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Date in BDB:
1/23/2022
Entry Details
US Patent