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Compile Data Set for Download or QSAR

Found 44 hits Enz. Inhib. hit(s) with all data for entry = 8289   
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 7


(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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2.5 -45.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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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5.70 -43.7n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 6


(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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11 -42.2n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
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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12 -42.0n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 13


(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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17 -41.2n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
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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25 -40.3n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 14


(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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41 -39.2n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 5B, mitochondrial


(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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54 -38.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(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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63 -38.2n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(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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74 -37.8n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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240 -35.1n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
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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250 -35.0n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 6


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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370 -34.1n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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370 -34.1n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5B, mitochondrial


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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380 -34.1n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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390 -34.0n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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400 -33.9n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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420 -33.8n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5B, mitochondrial


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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430 -33.8n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 6


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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460 -33.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 6


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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470 -33.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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800 -32.3n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 14


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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820 -32.3n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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840 -32.2n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 14


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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930 -32.0n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5B, mitochondrial


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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1.87E+3 -30.4n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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2.27E+3 -29.9n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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2.63E+3 -29.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 7


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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2.98E+3 -29.3n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 13


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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PubMed
5.34E+3 -28.0n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 14


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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6.25E+3 -27.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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7.11E+3 -27.3n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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5.30E+4 -22.7n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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1.04E+5 -21.1n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 13


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50095994
PNG
(3-Cyano-7-hydroxycoumarin (2) | 7-Hydroxy-2-oxo-2H...)
Show SMILES Oc1ccc2cc(C#N)c(=O)oc2c1
Show InChI InChI=1S/C10H5NO3/c11-5-7-3-6-1-2-8(12)4-9(6)14-10(7)13/h1-4,12H
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM239155
PNG
(7-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2c(C)cc(=O)oc2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-8-12(3-4-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 4


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair
Carbonic anhydrase 13


(Homo sapiens (Human))
BDBM239156
PNG
(6-O-[2-(2-methyl-5-nitro-imidazol-1-yl)ethyl]-4-me...)
Show SMILES Cc1ncc(n1CCOc1ccc2oc(=O)cc(C)c2c1)[N+]([O-])=O
Show InChI InChI=1S/C16H15N3O5/c1-10-7-16(20)24-14-4-3-12(8-13(10)14)23-6-5-18-11(2)17-9-15(18)19(21)22/h3-4,7-9H,5-6H2,1-2H3
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>2.00E+5>-19.6n/an/an/an/an/a7.54



Ecole Nationale Supérieure de Chimie de Montpellier



Assay Description
An Applied Photophysics stopped-flow instrument has been used for assaying the CA catalysed CO2 hydration activity. Phenol red (at a concentration of...


J Enzyme Inhib Med Chem 28: 397-401 (2013)


Article DOI: 10.3109/14756366.2011.650692
BindingDB Entry DOI: 10.7270/Q20Z726F
More data for this
Ligand-Target Pair