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PubMed code 25019479

Compile data set for download or QSAR
Found 96 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 9


(Homo sapiens (Human))
BDBM50050780
PNG
(CHEMBL3322523)
Show SMILES CC1=CC(=O)N(CC(=O)c2ccccc2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(15)13(19(16,17)18-9)8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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5.70n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
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)
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5.70n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 2


(Homo sapiens (Human))
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)
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12n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050779
PNG
(CHEMBL3322524)
Show SMILES CC1=CC(OCC(=O)c2ccccc2)=NS(=O)(=O)O1 |c:14,t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(13-19(15,16)18-9)17-8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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15n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050777
PNG
(CHEMBL3322525)
Show SMILES CC1=CC(=O)N(CC(=O)c2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O7S/c1-8-5-12(16)13(22(19,20)21-8)7-11(15)9-3-2-4-10(6-9)14(17)18/h2-6H,7H2,1H3
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16n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050777
PNG
(CHEMBL3322525)
Show SMILES CC1=CC(=O)N(CC(=O)c2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O7S/c1-8-5-12(16)13(22(19,20)21-8)7-11(15)9-3-2-4-10(6-9)14(17)18/h2-6H,7H2,1H3
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17n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050780
PNG
(CHEMBL3322523)
Show SMILES CC1=CC(=O)N(CC(=O)c2ccccc2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(15)13(19(16,17)18-9)8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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17n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050784
PNG
(CHEMBL3322451)
Show SMILES CC1=CC(=O)N(Cc2cccc(F)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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18n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
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)
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25n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050777
PNG
(CHEMBL3322525)
Show SMILES CC1=CC(=O)N(CC(=O)c2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O7S/c1-8-5-12(16)13(22(19,20)21-8)7-11(15)9-3-2-4-10(6-9)14(17)18/h2-6H,7H2,1H3
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26n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050841
PNG
(CHEMBL3322444)
Show SMILES CC1=CC(=O)N(Cc2ccccc2[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(14)12(20(17,18)19-8)7-9-4-2-3-5-10(9)13(15)16/h2-6H,7H2,1H3
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41n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050840
PNG
(CHEMBL3322445)
Show SMILES CC1=CC(OCc2ccccc2[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(12-20(16,17)19-8)18-7-9-4-2-3-5-10(9)13(14)15/h2-6H,7H2,1H3
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41n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050842
PNG
(CHEMBL3322443)
Show SMILES CCOC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:14,t:7|
Show InChI InChI=1S/C8H11NO6S/c1-3-13-8(10)5-14-7-4-6(2)15-16(11,12)9-7/h4H,3,5H2,1-2H3
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43n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050843
PNG
(CHEMBL3322442)
Show SMILES CCOC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:9|
Show InChI InChI=1S/C8H11NO6S/c1-3-14-8(11)5-9-7(10)4-6(2)15-16(9,12)13/h4H,3,5H2,1-2H3
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47n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050846
PNG
(CHEMBL3322439)
Show SMILES CC1=CC(OCC#N)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C6H6N2O4S/c1-5-4-6(11-3-2-7)8-13(9,10)12-5/h4H,3H2,1H3
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47n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050773
PNG
(CHEMBL3322437)
Show SMILES CC1=CC(OCC=C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h3,5H,1,4H2,2H3
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86n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050783
PNG
(CHEMBL3322452)
Show SMILES CC1=CC(OCc2cccc(F)c2)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(13-18(14,15)17-8)16-7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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92n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050774
PNG
(CHEMBL3321764)
Show SMILES CC1=CC(=O)N(CC=C)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-8-7(9)5-6(2)12-13(8,10)11/h3,5H,1,4H2,2H3
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103n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050774
PNG
(CHEMBL3321764)
Show SMILES CC1=CC(=O)N(CC=C)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-8-7(9)5-6(2)12-13(8,10)11/h3,5H,1,4H2,2H3
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114n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050779
PNG
(CHEMBL3322524)
Show SMILES CC1=CC(OCC(=O)c2ccccc2)=NS(=O)(=O)O1 |c:14,t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(13-19(15,16)18-9)17-8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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126n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050838
PNG
(CHEMBL3322447)
Show SMILES CC1=CC(OCc2cccc(c2)[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(12-20(16,17)19-8)18-7-9-3-2-4-10(6-9)13(14)15/h2-6H,7H2,1H3
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134n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050781
PNG
(CHEMBL3322522)
Show SMILES CC1=CC(=O)N(Cc2ccc(cc2)C#N)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O4S/c1-9-6-12(15)14(19(16,17)18-9)8-11-4-2-10(7-13)3-5-11/h2-6H,8H2,1H3
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136n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050844
PNG
(CHEMBL3322441)
Show SMILES CC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:12,t:5|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-12-7-3-6(2)13-14(10,11)8-7/h3H,4H2,1-2H3
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157n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050845
PNG
(CHEMBL3322440)
Show SMILES CC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:7|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-8-7(10)3-6(2)13-14(8,11)12/h3H,4H2,1-2H3
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159n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050782
PNG
(CHEMBL3322453)
Show SMILES CC1=CC(=O)N(Cc2c(F)cccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H9F2NO4S/c1-7-5-11(15)14(19(16,17)18-7)6-8-9(12)3-2-4-10(8)13/h2-5H,6H2,1H3
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170n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050786
PNG
(CHEMBL3322449)
Show SMILES CC1=CC(=O)N(Cc2cccc(Br)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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170n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050839
PNG
(CHEMBL3322446)
Show SMILES CC1=CC(=O)N(Cc2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(14)12(20(17,18)19-8)7-9-3-2-4-10(6-9)13(15)16/h2-6H,7H2,1H3
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177n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050772
PNG
(CHEMBL3322438)
Show SMILES CC1=CC(OCC#C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H7NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h1,5H,4H2,2H3
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178n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050787
PNG
(CHEMBL3322448)
Show SMILES CC1=CC(OCc2ccccc2Br)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-6-11(13-18(14,15)17-8)16-7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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180n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050785
PNG
(CHEMBL3322450)
Show SMILES CC1=CC(=O)N(Cc2ccccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-6-11(14)13(18(15,16)17-8)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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180n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050773
PNG
(CHEMBL3322437)
Show SMILES CC1=CC(OCC=C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h3,5H,1,4H2,2H3
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199n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050787
PNG
(CHEMBL3322448)
Show SMILES CC1=CC(OCc2ccccc2Br)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-6-11(13-18(14,15)17-8)16-7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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249n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
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)
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250n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050772
PNG
(CHEMBL3322438)
Show SMILES CC1=CC(OCC#C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H7NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h1,5H,4H2,2H3
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252n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050839
PNG
(CHEMBL3322446)
Show SMILES CC1=CC(=O)N(Cc2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(14)12(20(17,18)19-8)7-9-3-2-4-10(6-9)13(15)16/h2-6H,7H2,1H3
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267n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050784
PNG
(CHEMBL3322451)
Show SMILES CC1=CC(=O)N(Cc2cccc(F)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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275n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050786
PNG
(CHEMBL3322449)
Show SMILES CC1=CC(=O)N(Cc2cccc(Br)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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284n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050785
PNG
(CHEMBL3322450)
Show SMILES CC1=CC(=O)N(Cc2ccccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-6-11(14)13(18(15,16)17-8)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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285n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050781
PNG
(CHEMBL3322522)
Show SMILES CC1=CC(=O)N(Cc2ccc(cc2)C#N)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O4S/c1-9-6-12(15)14(19(16,17)18-9)8-11-4-2-10(7-13)3-5-11/h2-6H,8H2,1H3
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309n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050777
PNG
(CHEMBL3322525)
Show SMILES CC1=CC(=O)N(CC(=O)c2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O7S/c1-8-5-12(16)13(22(19,20)21-8)7-11(15)9-3-2-4-10(6-9)14(17)18/h2-6H,7H2,1H3
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1.30E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050841
PNG
(CHEMBL3322444)
Show SMILES CC1=CC(=O)N(Cc2ccccc2[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(14)12(20(17,18)19-8)7-9-4-2-3-5-10(9)13(15)16/h2-6H,7H2,1H3
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2.17E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050845
PNG
(CHEMBL3322440)
Show SMILES CC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:7|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-8-7(10)3-6(2)13-14(8,11)12/h3H,4H2,1-2H3
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2.18E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050775
PNG
(ACESULFAME POTASSIUM | Acesulfame Potassium | E950)
Show SMILES [K+].CC1=CC(=O)[N-]S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)/p-1
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2.41E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050844
PNG
(CHEMBL3322441)
Show SMILES CC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:12,t:5|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-12-7-3-6(2)13-14(10,11)8-7/h3H,4H2,1-2H3
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2.49E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050842
PNG
(CHEMBL3322443)
Show SMILES CCOC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:14,t:7|
Show InChI InChI=1S/C8H11NO6S/c1-3-13-8(10)5-14-7-4-6(2)15-16(11,12)9-7/h4H,3,5H2,1-2H3
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2.71E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050840
PNG
(CHEMBL3322445)
Show SMILES CC1=CC(OCc2ccccc2[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(12-20(16,17)19-8)18-7-9-4-2-3-5-10(9)13(14)15/h2-6H,7H2,1H3
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2.83E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050846
PNG
(CHEMBL3322439)
Show SMILES CC1=CC(OCC#N)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C6H6N2O4S/c1-5-4-6(11-3-2-7)8-13(9,10)12-5/h4H,3H2,1H3
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2.90E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050846
PNG
(CHEMBL3322439)
Show SMILES CC1=CC(OCC#N)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C6H6N2O4S/c1-5-4-6(11-3-2-7)8-13(9,10)12-5/h4H,3H2,1H3
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2.90E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050843
PNG
(CHEMBL3322442)
Show SMILES CCOC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:9|
Show InChI InChI=1S/C8H11NO6S/c1-3-14-8(11)5-9-7(10)4-6(2)15-16(9,12)13/h4H,3,5H2,1-2H3
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4.53E+3n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050845
PNG
(CHEMBL3322440)
Show SMILES CC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:7|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-8-7(10)3-6(2)13-14(8,11)12/h3H,4H2,1-2H3
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1.57E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050783
PNG
(CHEMBL3322452)
Show SMILES CC1=CC(OCc2cccc(F)c2)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(13-18(14,15)17-8)16-7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050787
PNG
(CHEMBL3322448)
Show SMILES CC1=CC(OCc2ccccc2Br)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-6-11(13-18(14,15)17-8)16-7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050839
PNG
(CHEMBL3322446)
Show SMILES CC1=CC(=O)N(Cc2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(14)12(20(17,18)19-8)7-9-3-2-4-10(6-9)13(15)16/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050840
PNG
(CHEMBL3322445)
Show SMILES CC1=CC(OCc2ccccc2[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(12-20(16,17)19-8)18-7-9-4-2-3-5-10(9)13(14)15/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050773
PNG
(CHEMBL3322437)
Show SMILES CC1=CC(OCC=C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h3,5H,1,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050840
PNG
(CHEMBL3322445)
Show SMILES CC1=CC(OCc2ccccc2[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(12-20(16,17)19-8)18-7-9-4-2-3-5-10(9)13(14)15/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050838
PNG
(CHEMBL3322447)
Show SMILES CC1=CC(OCc2cccc(c2)[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(12-20(16,17)19-8)18-7-9-3-2-4-10(6-9)13(14)15/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050782
PNG
(CHEMBL3322453)
Show SMILES CC1=CC(=O)N(Cc2c(F)cccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H9F2NO4S/c1-7-5-11(15)14(19(16,17)18-7)6-8-9(12)3-2-4-10(8)13/h2-5H,6H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050844
PNG
(CHEMBL3322441)
Show SMILES CC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:12,t:5|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-12-7-3-6(2)13-14(10,11)8-7/h3H,4H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050779
PNG
(CHEMBL3322524)
Show SMILES CC1=CC(OCC(=O)c2ccccc2)=NS(=O)(=O)O1 |c:14,t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(13-19(15,16)18-9)17-8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050843
PNG
(CHEMBL3322442)
Show SMILES CCOC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:9|
Show InChI InChI=1S/C8H11NO6S/c1-3-14-8(11)5-9-7(10)4-6(2)15-16(9,12)13/h4H,3,5H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050774
PNG
(CHEMBL3321764)
Show SMILES CC1=CC(=O)N(CC=C)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-8-7(9)5-6(2)12-13(8,10)11/h3,5H,1,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050781
PNG
(CHEMBL3322522)
Show SMILES CC1=CC(=O)N(Cc2ccc(cc2)C#N)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O4S/c1-9-6-12(15)14(19(16,17)18-9)8-11-4-2-10(7-13)3-5-11/h2-6H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050842
PNG
(CHEMBL3322443)
Show SMILES CCOC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:14,t:7|
Show InChI InChI=1S/C8H11NO6S/c1-3-13-8(10)5-14-7-4-6(2)15-16(11,12)9-7/h4H,3,5H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050841
PNG
(CHEMBL3322444)
Show SMILES CC1=CC(=O)N(Cc2ccccc2[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(14)12(20(17,18)19-8)7-9-4-2-3-5-10(9)13(15)16/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050775
PNG
(ACESULFAME POTASSIUM | Acesulfame Potassium | E950)
Show SMILES [K+].CC1=CC(=O)[N-]S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)/p-1
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050784
PNG
(CHEMBL3322451)
Show SMILES CC1=CC(=O)N(Cc2cccc(F)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050785
PNG
(CHEMBL3322450)
Show SMILES CC1=CC(=O)N(Cc2ccccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-6-11(14)13(18(15,16)17-8)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050846
PNG
(CHEMBL3322439)
Show SMILES CC1=CC(OCC#N)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C6H6N2O4S/c1-5-4-6(11-3-2-7)8-13(9,10)12-5/h4H,3H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050787
PNG
(CHEMBL3322448)
Show SMILES CC1=CC(OCc2ccccc2Br)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-6-11(13-18(14,15)17-8)16-7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050786
PNG
(CHEMBL3322449)
Show SMILES CC1=CC(=O)N(Cc2cccc(Br)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050784
PNG
(CHEMBL3322451)
Show SMILES CC1=CC(=O)N(Cc2cccc(F)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050773
PNG
(CHEMBL3322437)
Show SMILES CC1=CC(OCC=C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h3,5H,1,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050785
PNG
(CHEMBL3322450)
Show SMILES CC1=CC(=O)N(Cc2ccccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-6-11(14)13(18(15,16)17-8)7-9-4-2-3-5-10(9)12/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050838
PNG
(CHEMBL3322447)
Show SMILES CC1=CC(OCc2cccc(c2)[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(12-20(16,17)19-8)18-7-9-3-2-4-10(6-9)13(14)15/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050772
PNG
(CHEMBL3322438)
Show SMILES CC1=CC(OCC#C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H7NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h1,5H,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050782
PNG
(CHEMBL3322453)
Show SMILES CC1=CC(=O)N(Cc2c(F)cccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H9F2NO4S/c1-7-5-11(15)14(19(16,17)18-7)6-8-9(12)3-2-4-10(8)13/h2-5H,6H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050783
PNG
(CHEMBL3322452)
Show SMILES CC1=CC(OCc2cccc(F)c2)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(13-18(14,15)17-8)16-7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050838
PNG
(CHEMBL3322447)
Show SMILES CC1=CC(OCc2cccc(c2)[N+]([O-])=O)=NS(=O)(=O)O1 |c:15,t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(12-20(16,17)19-8)18-7-9-3-2-4-10(6-9)13(14)15/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050841
PNG
(CHEMBL3322444)
Show SMILES CC1=CC(=O)N(Cc2ccccc2[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-6-11(14)12(20(17,18)19-8)7-9-4-2-3-5-10(9)13(15)16/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050772
PNG
(CHEMBL3322438)
Show SMILES CC1=CC(OCC#C)=NS(=O)(=O)O1 |c:7,t:1|
Show InChI InChI=1S/C7H7NO4S/c1-3-4-11-7-5-6(2)12-13(9,10)8-7/h1,5H,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050782
PNG
(CHEMBL3322453)
Show SMILES CC1=CC(=O)N(Cc2c(F)cccc2F)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H9F2NO4S/c1-7-5-11(15)14(19(16,17)18-7)6-8-9(12)3-2-4-10(8)13/h2-5H,6H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50050775
PNG
(ACESULFAME POTASSIUM | Acesulfame Potassium | E950)
Show SMILES [K+].CC1=CC(=O)[N-]S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)/p-1
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 12 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050775
PNG
(ACESULFAME POTASSIUM | Acesulfame Potassium | E950)
Show SMILES [K+].CC1=CC(=O)[N-]S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C4H5NO4S/c1-3-2-4(6)5-10(7,8)9-3/h2H,1H3,(H,5,6)/p-1
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050786
PNG
(CHEMBL3322449)
Show SMILES CC1=CC(=O)N(Cc2cccc(Br)c2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10BrNO4S/c1-8-5-11(14)13(18(15,16)17-8)7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050844
PNG
(CHEMBL3322441)
Show SMILES CC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:12,t:5|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-12-7-3-6(2)13-14(10,11)8-7/h3H,4H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050839
PNG
(CHEMBL3322446)
Show SMILES CC1=CC(=O)N(Cc2cccc(c2)[N+]([O-])=O)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C11H10N2O6S/c1-8-5-11(14)12(20(17,18)19-8)7-9-3-2-4-10(6-9)13(15)16/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050783
PNG
(CHEMBL3322452)
Show SMILES CC1=CC(OCc2cccc(F)c2)=NS(=O)(=O)O1 |c:13,t:1|
Show InChI InChI=1S/C11H10FNO4S/c1-8-5-11(13-18(14,15)17-8)16-7-9-3-2-4-10(12)6-9/h2-6H,7H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050779
PNG
(CHEMBL3322524)
Show SMILES CC1=CC(OCC(=O)c2ccccc2)=NS(=O)(=O)O1 |c:14,t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(13-19(15,16)18-9)17-8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050780
PNG
(CHEMBL3322523)
Show SMILES CC1=CC(=O)N(CC(=O)c2ccccc2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(15)13(19(16,17)18-9)8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050843
PNG
(CHEMBL3322442)
Show SMILES CCOC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:9|
Show InChI InChI=1S/C8H11NO6S/c1-3-14-8(11)5-9-7(10)4-6(2)15-16(9,12)13/h4H,3,5H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050842
PNG
(CHEMBL3322443)
Show SMILES CCOC(=O)COC1=NS(=O)(=O)OC(C)=C1 |c:14,t:7|
Show InChI InChI=1S/C8H11NO6S/c1-3-13-8(10)5-14-7-4-6(2)15-16(11,12)9-7/h4H,3,5H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050780
PNG
(CHEMBL3322523)
Show SMILES CC1=CC(=O)N(CC(=O)c2ccccc2)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H11NO5S/c1-9-7-12(15)13(19(16,17)18-9)8-11(14)10-5-3-2-4-6-10/h2-7H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50050845
PNG
(CHEMBL3322440)
Show SMILES CC(=O)CN1C(=O)C=C(C)OS1(=O)=O |t:7|
Show InChI InChI=1S/C7H9NO5S/c1-5(9)4-8-7(10)3-6(2)13-14(8,11)12/h3H,4H2,1-2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 9 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50050774
PNG
(CHEMBL3321764)
Show SMILES CC1=CC(=O)N(CC=C)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C7H9NO4S/c1-3-4-8-7(9)5-6(2)12-13(8,10)11/h3,5H,1,4H2,2H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 2 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50050781
PNG
(CHEMBL3322522)
Show SMILES CC1=CC(=O)N(Cc2ccc(cc2)C#N)S(=O)(=O)O1 |t:1|
Show InChI InChI=1S/C12H10N2O4S/c1-9-6-12(15)14(19(16,17)18-9)8-11-4-2-10(7-13)3-5-11/h2-6H,8H2,1H3
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>2.00E+4n/an/an/an/an/an/an/an/a



Sapienza University of Rome

Curated by ChEMBL


Assay Description
Inhibition of human recombinant carbonic anhydrase 1 by stopped flow CO2 hydration method


Eur J Med Chem 84: 240-6 (2014)


Article DOI: 10.1016/j.ejmech.2014.07.014
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%