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PubMed code 23339426

Compile data set for download or QSAR
Found 46 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
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246528
PNG
(Saccharin derivative, 6b)
Show SMILES COc1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C15H13N3O5S/c1-23-11-4-2-3-9(7-11)16-15(20)17-10-5-6-12-13(8-10)24(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 6.54E+3n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246543
PNG
(Saccharin derivative, 6q)
Show SMILES Fc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10FN3O3S2/c15-8-1-3-9(4-2-8)16-14(22)17-10-5-6-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 8.10E+3n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246547
PNG
(Saccharin derivative, 6u)
Show SMILES Clc1cc(Cl)cc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H9Cl2N3O3S2/c15-7-3-8(16)5-10(4-7)18-14(23)17-9-1-2-11-12(6-9)24(21,22)19-13(11)20/h1-6H,(H,19,20)(H2,17,18,23)
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n/an/a 1.10E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246539
PNG
(Saccharin derivative, 6m)
Show SMILES Cc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O3S2/c1-9-2-4-10(5-3-9)16-15(22)17-11-6-7-12-13(8-11)23(20,21)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,22)
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n/an/a 1.11E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246546
PNG
(Saccharin derivative, 6t)
Show SMILES Clc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c(Cl)c1
Show InChI InChI=1S/C14H9Cl2N3O3S2/c15-7-1-4-11(10(16)5-7)18-14(23)17-8-2-3-9-12(6-8)24(21,22)19-13(9)20/h1-6H,(H,19,20)(H2,17,18,23)
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n/an/a 1.25E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246533
PNG
(Saccharin derivative, 6g)
Show SMILES Clc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1Cl
Show InChI InChI=1S/C14H9Cl2N3O4S/c15-10-4-2-7(5-11(10)16)17-14(21)18-8-1-3-9-12(6-8)24(22,23)19-13(9)20/h1-6H,(H,19,20)(H2,17,18,21)
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n/an/a 1.27E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246539
PNG
(Saccharin derivative, 6m)
Show SMILES Cc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O3S2/c1-9-2-4-10(5-3-9)16-15(22)17-11-6-7-12-13(8-11)23(20,21)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,22)
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n/an/a 1.37E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246542
PNG
(Saccharin derivative, 6p)
Show SMILES Fc1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10FN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 1.46E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246537
PNG
(Saccharin derivative, 6k)
Show SMILES Fc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10FN3O4S/c15-8-1-3-9(4-2-8)16-14(20)17-10-5-6-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 1.71E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246545
PNG
(Saccharin derivative, 6s)
Show SMILES Clc1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10ClN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 1.72E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246531
PNG
(Saccharin derivative, 6e)
Show SMILES Clc1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10ClN3O4S/c15-8-2-1-3-9(6-8)16-14(20)17-10-4-5-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 1.78E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246544
PNG
(Saccharin derivative, 6r)
Show SMILES Ic1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10IN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 2.02E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246527
PNG
(Saccharin derivative, 6a)
Show SMILES O=C(Nc1ccccc1)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H11N3O4S/c18-13-11-7-6-10(8-12(11)22(20,21)17-13)16-14(19)15-9-4-2-1-3-5-9/h1-8H,(H,17,18)(H2,15,16,19)
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n/an/a 2.11E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246532
PNG
(Saccharin derivative, 6f)
Show SMILES Clc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10ClN3O4S/c15-8-1-3-9(4-2-8)16-14(20)17-10-5-6-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 2.37E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246530
PNG
(Saccharin derivative, 6d)
Show SMILES Cc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O4S/c1-9-2-4-10(5-3-9)16-15(20)17-11-6-7-12-13(8-11)23(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 2.47E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246547
PNG
(Saccharin derivative, 6u)
Show SMILES Clc1cc(Cl)cc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H9Cl2N3O3S2/c15-7-3-8(16)5-10(4-7)18-14(23)17-9-1-2-11-12(6-9)24(21,22)19-13(11)20/h1-6H,(H,19,20)(H2,17,18,23)
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n/an/a 2.61E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246541
PNG
(Saccharin derivative, 6o)
Show SMILES Fc1ccccc1NC(=S)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H10FN3O3S2/c15-10-3-1-2-4-11(10)17-14(22)16-8-5-6-9-12(7-8)23(20,21)18-13(9)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 3.02E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246540
PNG
(Saccharin derivative, 6n)
Show SMILES COc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O4S2/c1-22-11-5-2-9(3-6-11)16-15(23)17-10-4-7-12-13(8-10)24(20,21)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,23)
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n/an/a 3.03E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246544
PNG
(Saccharin derivative, 6r)
Show SMILES Ic1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10IN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 3.07E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246530
PNG
(Saccharin derivative, 6d)
Show SMILES Cc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O4S/c1-9-2-4-10(5-3-9)16-15(20)17-11-6-7-12-13(8-11)23(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 3.08E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246534
PNG
(Saccharin derivative, 6h)
Show SMILES [O-][N+](=O)c1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10N4O6S/c19-13-11-5-4-9(7-12(11)25(23,24)17-13)16-14(20)15-8-2-1-3-10(6-8)18(21)22/h1-7H,(H,17,19)(H2,15,16,20)
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n/an/a 3.27E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246545
PNG
(Saccharin derivative, 6s)
Show SMILES Clc1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10ClN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 3.34E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246529
PNG
(Saccharin derivative, 6c)
Show SMILES COc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O5S/c1-23-11-5-2-9(3-6-11)16-15(20)17-10-4-7-12-13(8-10)24(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 3.46E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246533
PNG
(Saccharin derivative, 6g)
Show SMILES Clc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1Cl
Show InChI InChI=1S/C14H9Cl2N3O4S/c15-10-4-2-7(5-11(10)16)17-14(21)18-8-1-3-9-12(6-8)24(22,23)19-13(9)20/h1-6H,(H,19,20)(H2,17,18,21)
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n/an/a 3.74E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246534
PNG
(Saccharin derivative, 6h)
Show SMILES [O-][N+](=O)c1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10N4O6S/c19-13-11-5-4-9(7-12(11)25(23,24)17-13)16-14(20)15-8-2-1-3-10(6-8)18(21)22/h1-7H,(H,17,19)(H2,15,16,20)
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n/an/a 3.75E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246529
PNG
(Saccharin derivative, 6c)
Show SMILES COc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O5S/c1-23-11-5-2-9(3-6-11)16-15(20)17-10-4-7-12-13(8-10)24(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 3.77E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246535
PNG
(Saccharin derivative, 6i)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10N4O6S/c19-13-11-6-3-9(7-12(11)25(23,24)17-13)16-14(20)15-8-1-4-10(5-2-8)18(21)22/h1-7H,(H,17,19)(H2,15,16,20)
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n/an/a 3.89E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246531
PNG
(Saccharin derivative, 6e)
Show SMILES Clc1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10ClN3O4S/c15-8-2-1-3-9(6-8)16-14(20)17-10-4-5-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 3.90E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246538
PNG
(Saccharin derivative, 6l)
Show SMILES O=C1NS(=O)(=O)c2cc(NC(=S)Nc3ccccc3)ccc12
Show InChI InChI=1S/C14H11N3O3S2/c18-13-11-7-6-10(8-12(11)22(19,20)17-13)16-14(21)15-9-4-2-1-3-5-9/h1-8H,(H,17,18)(H2,15,16,21)
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n/an/a 4.02E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246536
PNG
(Saccharin derivative, 6j)
Show SMILES Fc1ccccc1NC(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H10FN3O4S/c15-10-3-1-2-4-11(10)17-14(20)16-8-5-6-9-12(7-8)23(21,22)18-13(9)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 4.16E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246528
PNG
(Saccharin derivative, 6b)
Show SMILES COc1cccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C15H13N3O5S/c1-23-11-4-2-3-9(7-11)16-15(20)17-10-5-6-12-13(8-10)24(21,22)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,20)
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n/an/a 4.17E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246537
PNG
(Saccharin derivative, 6k)
Show SMILES Fc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10FN3O4S/c15-8-1-3-9(4-2-8)16-14(20)17-10-5-6-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 4.26E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246540
PNG
(Saccharin derivative, 6n)
Show SMILES COc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C15H13N3O4S2/c1-22-11-5-2-9(3-6-11)16-15(23)17-10-4-7-12-13(8-10)24(20,21)18-14(12)19/h2-8H,1H3,(H,18,19)(H2,16,17,23)
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n/an/a 4.33E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM246548
PNG
(Saccharin derivative, 6v)
Show SMILES [O-][N+](=O)c1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10N4O5S2/c19-13-11-6-3-9(7-12(11)25(22,23)17-13)16-14(24)15-8-1-4-10(5-2-8)18(20)21/h1-7H,(H,17,19)(H2,15,16,24)
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n/an/a 4.35E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246536
PNG
(Saccharin derivative, 6j)
Show SMILES Fc1ccccc1NC(=O)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H10FN3O4S/c15-10-3-1-2-4-11(10)17-14(20)16-8-5-6-9-12(7-8)23(21,22)18-13(9)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 4.47E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246542
PNG
(Saccharin derivative, 6p)
Show SMILES Fc1cccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c1
Show InChI InChI=1S/C14H10FN3O3S2/c15-8-2-1-3-9(6-8)16-14(22)17-10-4-5-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 4.67E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246538
PNG
(Saccharin derivative, 6l)
Show SMILES O=C1NS(=O)(=O)c2cc(NC(=S)Nc3ccccc3)ccc12
Show InChI InChI=1S/C14H11N3O3S2/c18-13-11-7-6-10(8-12(11)22(19,20)17-13)16-14(21)15-9-4-2-1-3-5-9/h1-8H,(H,17,18)(H2,15,16,21)
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n/an/a 4.67E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246548
PNG
(Saccharin derivative, 6v)
Show SMILES [O-][N+](=O)c1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10N4O5S2/c19-13-11-6-3-9(7-12(11)25(22,23)17-13)16-14(24)15-8-1-4-10(5-2-8)18(20)21/h1-7H,(H,17,19)(H2,15,16,24)
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n/an/a 4.77E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM50004506
PNG
(6-Aminosaccharin | CHEMBL2016952 | Saccharin deriv...)
Show SMILES Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C7H6N2O3S/c8-4-1-2-5-6(3-4)13(11,12)9-7(5)10/h1-3H,8H2,(H,9,10)
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n/an/a 4.90E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246535
PNG
(Saccharin derivative, 6i)
Show SMILES [O-][N+](=O)c1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10N4O6S/c19-13-11-6-3-9(7-12(11)25(23,24)17-13)16-14(20)15-8-1-4-10(5-2-8)18(21)22/h1-7H,(H,17,19)(H2,15,16,20)
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n/an/a 5.42E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM50004506
PNG
(6-Aminosaccharin | CHEMBL2016952 | Saccharin deriv...)
Show SMILES Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C7H6N2O3S/c8-4-1-2-5-6(3-4)13(11,12)9-7(5)10/h1-3H,8H2,(H,9,10)
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n/an/a 5.49E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246543
PNG
(Saccharin derivative, 6q)
Show SMILES Fc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10FN3O3S2/c15-8-1-3-9(4-2-8)16-14(22)17-10-5-6-11-12(7-10)23(20,21)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,22)
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UniChem
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n/an/a 5.59E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246546
PNG
(Saccharin derivative, 6t)
Show SMILES Clc1ccc(NC(=S)Nc2ccc3C(=O)NS(=O)(=O)c3c2)c(Cl)c1
Show InChI InChI=1S/C14H9Cl2N3O3S2/c15-7-1-4-11(10(16)5-7)18-14(23)17-8-2-3-9-12(6-8)24(21,22)19-13(9)20/h1-6H,(H,19,20)(H2,17,18,23)
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n/an/a 5.94E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246532
PNG
(Saccharin derivative, 6f)
Show SMILES Clc1ccc(NC(=O)Nc2ccc3C(=O)NS(=O)(=O)c3c2)cc1
Show InChI InChI=1S/C14H10ClN3O4S/c15-8-1-3-9(4-2-8)16-14(20)17-10-5-6-11-12(7-10)23(21,22)18-13(11)19/h1-7H,(H,18,19)(H2,16,17,20)
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n/an/a 6.30E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246527
PNG
(Saccharin derivative, 6a)
Show SMILES O=C(Nc1ccccc1)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H11N3O4S/c18-13-11-7-6-10(8-12(11)22(20,21)17-13)16-14(19)15-9-4-2-1-3-5-9/h1-8H,(H,17,18)(H2,15,16,19)
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n/an/a 6.31E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (human))
BDBM246541
PNG
(Saccharin derivative, 6o)
Show SMILES Fc1ccccc1NC(=S)Nc1ccc2C(=O)NS(=O)(=O)c2c1
Show InChI InChI=1S/C14H10FN3O3S2/c15-10-3-1-2-4-11(10)17-14(22)16-8-5-6-9-12(7-8)23(20,21)18-13(9)19/h1-7H,(H,18,19)(H2,16,17,22)
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n/an/a 7.49E+4n/an/an/an/an/an/a



Sakarya University



Assay Description
For the inhibition studies of saccharin, different concentrations of these compounds were added to the enzyme. Activity percentage values of CA for d...


J Enzyme Inhib Med Chem 29: 118-23 (2014)


Article DOI: 10.3109/14756366.2012.757222
BindingDB Entry DOI: 10.7270/Q2WM1C9V
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%