BDBM18134 ({[({[(2R,3S,4R,5R)-5-(6-amino-9H-purin-9-yl)-3,4-dihydroxyoxolan-2-yl]methoxy}(hydroxy)phosphoryl)oxy](hydroxy)phosphoryl}amino)phosphonic acid::5-Adenylyl imidodiphosphate::AMP.P[NH]P::AMPPNP
SMILES Nc1ncnc2n(cnc12)[C@@H]1O[C@H](COP(O)(=O)OP(O)(=O)NP(O)(O)=O)[C@@H](O)[C@H]1O
InChI Key InChIKey=PVKSNHVPLWYQGJ-KQYNXXCUSA-N
Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB
Found 5 hits for monomerid = 18134
Affinity DataKi: 4.00E+3nMAssay Description:Inhibitory constant against rat Methionine adenosyltransferase was reportedMore data for this Ligand-Target Pair
Affinity DataKi: 5.50E+3nMAssay Description:Inhibitory constant against rat kidney Methionine adenosyltransferase IIMore data for this Ligand-Target Pair
Affinity DataKi: 2.00E+4nM ΔG°: -6.41kcal/mole IC50: 1.00E+5nMpH: 7.5 T: 2°CAssay Description:Aminoacyl-tRNA synthetase assays were measuring the incorporation of [14C] amino acid into tRNA.More data for this Ligand-Target Pair
Affinity DataKi: 9.00E+5nMAssay Description:Tested for its binding affinity against glycerol kinase (ATP competitive inhibition)More data for this Ligand-Target Pair
Affinity DataIC50: 2.28E+5nMAssay Description:Inhibition of Streptococcus pneumoniae VicK autophosphorylation using compound at non-aggregating concentration after 30 mins in presence of [gamma-3...More data for this Ligand-Target Pair
Activity Spreadsheet -- ITC Data from BindingDB
Found 10 hits for monomerid = 18134
ITC DataΔG°: -7.57kcal/mole −TΔS°: 9.29kcal/mole ΔH°: -16.2kcal/mole logk: 3.70E+5
pH: 7.2 T: 24.85°C
pH: 7.2 T: 24.85°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.61kcal/mole −TΔS°: 3.56kcal/mole ΔH°: -9.17kcal/mole logk: 2.30E+4
pH: 8.0 T: 8.00°C
pH: 8.0 T: 8.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.57kcal/mole −TΔS°: 3.10kcal/mole ΔH°: -8.67kcal/mole logk: 1.90E+4
pH: 8.0 T: 10.00°C
pH: 8.0 T: 10.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.45kcal/mole −TΔS°: 3.13kcal/mole ΔH°: -8.57kcal/mole logk: 1.30E+4
pH: 8.0 T: 15.00°C
pH: 8.0 T: 15.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.40kcal/mole −TΔS°: 2.77kcal/mole ΔH°: -8.17kcal/mole logk: 1.10E+4
pH: 8.0 T: 20.00°C
pH: 8.0 T: 20.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.59kcal/mole −TΔS°: 3.42kcal/mole ΔH°: -9.02kcal/mole logk: 2.20E+4
pH: 8.0 T: 8.00°C
pH: 8.0 T: 8.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.56kcal/mole −TΔS°: 2.97kcal/mole ΔH°: -8.52kcal/mole logk: 1.80E+4
pH: 8.0 T: 12.00°C
pH: 8.0 T: 12.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.47kcal/mole −TΔS°: 2.72kcal/mole ΔH°: -8.20kcal/mole logk: 1.40E+4
pH: 8.0 T: 16.00°C
pH: 8.0 T: 16.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.48kcal/mole −TΔS°: 2.33kcal/mole ΔH°: -7.81kcal/mole logk: 8.50E+3
pH: 8.0 T: 25.00°C
pH: 8.0 T: 25.00°C
CellHeat Shock Protein 90 (Hsp90)(Saccharomyces cerevisiae (Baker s yeast))
University College London
University College London
ITC DataΔG°: -5.30kcal/mole −TΔS°: 2.68kcal/mole ΔH°: -7.98kcal/mole logk: 7.70E+3
pH: 8.0 T: 25.00°C
pH: 8.0 T: 25.00°C