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PubMed code 24657053

Compile data set for download or QSAR
Found 8 hits of Enzyme Inhibition Constant Data   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Glucosylceramidase


(Homo sapiens (human))
BDBM36389
PNG
(8-Aza-bicyclo[3.2.1]octane-1,2,3,4-tetraol, 14 | C...)
Show SMILES O[C@H]1[C@H]2CC[C@](O)(N2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4+,5-,6+,7-/m1/s1
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Article
PubMed
3.80E+3n/an/an/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Competitive inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002856
PNG
(CHEMBL3233942)
Show SMILES O[C@@H]1C[C@H]2CC[C@](O)(N2)[C@H]1O
Show InChI InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5-,6+,7-/m1/s1
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PubMed
6.30E+3n/an/an/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Competitive inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002909
PNG
(CHEMBL3233945)
Show SMILES O[C@@H]1[C@H]2CC[C@](O)(N2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4-,5-,6+,7-/m1/s1
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PubMed
9.80E+4n/an/an/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Competitive inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002857
PNG
(CHEMBL3233944)
Show SMILES O[C@H]1[C@H]2CC[C@](O)(N2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4+,5-,6-,7-/m1/s1
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PubMed
1.99E+5n/an/an/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Competitive inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM36389
PNG
(8-Aza-bicyclo[3.2.1]octane-1,2,3,4-tetraol, 14 | C...)
Show SMILES O[C@H]1[C@H]2CC[C@](O)(N2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4+,5-,6+,7-/m1/s1
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Article
PubMed
n/an/a 5.10E+3n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 mins before ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002856
PNG
(CHEMBL3233942)
Show SMILES O[C@@H]1C[C@H]2CC[C@](O)(N2)[C@H]1O
Show InChI InChI=1S/C7H13NO3/c9-5-3-4-1-2-7(11,8-4)6(5)10/h4-6,8-11H,1-3H2/t4-,5-,6+,7-/m1/s1
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PubMed
n/an/a 1.60E+4n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 mins before ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002909
PNG
(CHEMBL3233945)
Show SMILES O[C@@H]1[C@H]2CC[C@](O)(N2)[C@@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4-,5-,6+,7-/m1/s1
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PubMed
n/an/a 1.75E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 mins before ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
Glucosylceramidase


(Homo sapiens (human))
BDBM50002857
PNG
(CHEMBL3233944)
Show SMILES O[C@H]1[C@H]2CC[C@](O)(N2)[C@H](O)[C@@H]1O
Show InChI InChI=1S/C7H13NO4/c9-4-3-1-2-7(12,8-3)6(11)5(4)10/h3-6,8-12H,1-2H2/t3-,4+,5-,6-,7-/m1/s1
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Article
PubMed
n/an/a 6.16E+5n/an/an/an/an/an/a



University of Toyama

Curated by ChEMBL


Assay Description
Inhibition of human lysosomal beta-glucocerebrosidase using 4-methylumbelliferyl-beta-D-glucopyranoside as substrate preincubated for 45 mins before ...


Bioorg Med Chem 22: 2435-41 (2014)


Article DOI: 10.1016/j.bmc.2014.02.057
BindingDB Entry DOI: 10.7270/Q24X599T
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%