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PubMed code 23311862

Compile data set for download or QSAR
Found 12 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 1


(Homo sapiens (Human))		BDBM246518
PNG
(N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)methane...)
Show SMILES COc1cc2CC(Cc2cc1OC)NS(C)(=O)=O
Show InChI InChI=1S/C12H17NO4S/c1-16-11-6-8-4-10(13-18(3,14)15)5-9(8)7-12(11)17-2/h6-7,10,13H,4-5H2,1-3H3
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UniChem
Article
PubMed
 4.60E+4n/a 2.66E+5n/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))		BDBM246514
PNG
(N-(5,6-dimethoxyindane-1-yl)methanesulfonamide (28...)
Show SMILES COc1cc2CCC(NS(C)(=O)=O)c2cc1OC
Show InChI InChI=1S/C12H17NO4S/c1-16-11-6-8-4-5-10(13-18(3,14)15)9(8)7-12(11)17-2/h6-7,10,13H,4-5H2,1-3H3
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PubMed
 5.20E+4n/a 4.87E+5n/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246517
PNG
(N-(1,2,3,4-tetrahydronaphthalene -2-yl)methanesulf...)
Show SMILES CS(=O)(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C11H15NO2S/c1-15(13,14)12-11-7-6-9-4-2-3-5-10(9)8-11/h2-5,11-12H,6-8H2,1H3
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PubMed
 9.40E+4n/a 3.38E+5n/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))		BDBM246519
PNG
(N-(Indane-2-yl)methanesulfonamide (33))
Show SMILES CS(=O)(=O)NC1Cc2ccccc2C1
Show InChI InChI=1S/C10H13NO2S/c1-14(12,13)11-10-6-8-4-2-3-5-9(8)7-10/h2-5,10-11H,6-7H2,1H3
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PubMed
 1.04E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246516
PNG
(N-(5-metoksi-1,2,3,4-tetrahydronaphthalene-1-yl)me...)
Show SMILES COc1cccc2C(CCCc12)NS(C)(=O)=O
Show InChI InChI=1S/C12H17NO3S/c1-16-12-8-4-5-9-10(12)6-3-7-11(9)13-17(2,14)15/h4-5,8,11,13H,3,6-7H2,1-2H3
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PubMed
 1.12E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246519
PNG
(N-(Indane-2-yl)methanesulfonamide (33))
Show SMILES CS(=O)(=O)NC1Cc2ccccc2C1
Show InChI InChI=1S/C10H13NO2S/c1-14(12,13)11-10-6-8-4-2-3-5-9(8)7-10/h2-5,10-11H,6-7H2,1H3
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PubMed
 1.70E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))		BDBM246515
PNG
(N-(Indane-1-yl)methanesulfonamide (29))
Show SMILES CS(=O)(=O)NC1CCc2ccccc12
Show InChI InChI=1S/C10H13NO2S/c1-14(12,13)11-10-7-6-8-4-2-3-5-9(8)10/h2-5,10-11H,6-7H2,1H3
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PubMed
 1.73E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))		BDBM246516
PNG
(N-(5-metoksi-1,2,3,4-tetrahydronaphthalene-1-yl)me...)
Show SMILES COc1cccc2C(CCCc12)NS(C)(=O)=O
Show InChI InChI=1S/C12H17NO3S/c1-16-12-8-4-5-9-10(12)6-3-7-11(9)13-17(2,14)15/h4-5,8,11,13H,3,6-7H2,1-2H3
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PubMed
 1.85E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246515
PNG
(N-(Indane-1-yl)methanesulfonamide (29))
Show SMILES CS(=O)(=O)NC1CCc2ccccc12
Show InChI InChI=1S/C10H13NO2S/c1-14(12,13)11-10-7-6-8-4-2-3-5-9(8)10/h2-5,10-11H,6-7H2,1H3
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UniChem
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PubMed
 2.11E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246514
PNG
(N-(5,6-dimethoxyindane-1-yl)methanesulfonamide (28...)
Show SMILES COc1cc2CCC(NS(C)(=O)=O)c2cc1OC
Show InChI InChI=1S/C12H17NO4S/c1-16-11-6-8-4-5-10(13-18(3,14)15)9(8)7-12(11)17-2/h6-7,10,13H,4-5H2,1-3H3
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PubMed
 2.15E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))		BDBM246517
PNG
(N-(1,2,3,4-tetrahydronaphthalene -2-yl)methanesulf...)
Show SMILES CS(=O)(=O)NC1CCc2ccccc2C1
Show InChI InChI=1S/C11H15NO2S/c1-15(13,14)12-11-7-6-9-4-2-3-5-10(9)8-11/h2-5,11-12H,6-8H2,1H3
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PubMed
 2.28E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))		BDBM246518
PNG
(N-(5,6-dimethoxy-2,3-dihydro-1H-inden-2-yl)methane...)
Show SMILES COc1cc2CC(Cc2cc1OC)NS(C)(=O)=O
Show InChI InChI=1S/C12H17NO4S/c1-16-11-6-8-4-10(13-18(3,14)15)5-9(8)7-12(11)17-2/h6-7,10,13H,4-5H2,1-3H3
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 3.72E+5n/an/an/an/an/an/an/an/a



Atatürk University



Assay Description
The effect of novel sulfonamides 28-33 on HCA isozyme activity was determined colorimetrically using CO2-hydration method of Wilbur and Anderson29 de...

J Enzyme Inhib Med Chem 29: 35-42 (2014)


Article DOI: 10.3109/14756366.2012.750311
BindingDB Entry DOI: 10.7270/Q2513X4M
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%