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PubMed code 19574046

Compile data set for download or QSAR
Found 5 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


(Candida glabrata)
BDBM10880
PNG
(AZA | AZA2 | AZM acetazolamide | Acerazolamide, AA...)
Show SMILES CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C4H6N4O3S2/c1-2(9)6-3-7-8-4(12-3)13(5,10)11/h1H3,(H2,5,10,11)(H,6,7,9)
KEGG

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Article
PubMed
11n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Candida glabrata)
BDBM26997
PNG
(CHEMBL364571 | PhAsO3H2 | benzenarsonic acid | ben...)
Show SMILES O[As](O)(=O)c1ccccc1
Show InChI InChI=1S/C6H7AsO3/c8-7(9,10)6-4-2-1-3-5-6/h1-5H,(H2,8,9,10)
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PubMed
9.80E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Candida glabrata)
BDBM26996
PNG
(CHEMBL21485 | PhB(OH)2 | Phenyl-boronic acid | Phe...)
Show SMILES OB(O)c1ccccc1
Show InChI InChI=1S/C6H7BO2/c8-7(9)6-4-2-1-3-5-6/h1-5,8-9H
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PubMed
1.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Candida glabrata)
BDBM50297924
PNG
(CHEMBL232233 | H2NSO3H | sodium sulfamate)
Show SMILES NS([O-])(=O)=O
Show InChI InChI=1S/H3NO3S/c1-5(2,3)4/h(H3,1,2,3,4)/p-1
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PubMed
1.10E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Candida glabrata)
BDBM26995
PNG
(CHEMBL355001 | H2NSO2NH2 | sulfamamide | sulfamide...)
Show SMILES NS(N)(=O)=O
Show InChI InChI=1S/H4N2O2S/c1-5(2,3)4/h(H4,1,2,3,4)
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PubMed
4.20E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of Candida glabrata carbonic anhydrase by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4802-5 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.048
BindingDB Entry DOI: 10.7270/Q2R212BT
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%