BDBM228804 N-(N'-butylthiocarbamoyl)-1-deoxygalactonojirimycin::NBT-DGJ

SMILES CCCCNC(=S)N1CC(O)[C@@H](O)[C@@H](O)C1CO

InChI Key InChIKey=VCRXDLDGTLMSHK-UHFFFAOYSA-N

Data  3 KI

  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 3 hits for monomerid = 228804   

TargetBeta-galactosidase [24-677](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.73E+5nM ΔG°:  -4.86kcal/molepH: 4.5 T: 2°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-galactosidase [24-677,R201C](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.88E+5nM ΔG°:  -4.84kcal/molepH: 4.5 T: 2°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed
TargetBeta-galactosidase [24-677,I51T](Human)
The University of Tokyo

LigandPNGBDBM228804(N-(N'-butylthiocarbamoyl)-1-deoxygalactonojiri...)
Affinity DataKi:  3.29E+5nM ΔG°:  -4.94kcal/molepH: 4.5 T: 2°CAssay Description:β-Gal activity was measured by using 4-methylumbelliferyll-β-D-galactopyranoside in buffer B (0.15 M sodium citrate, pH 4.5, and 0.2 M NaCl...More data for this Ligand-Target Pair
In DepthDetails Article
PubMed