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Compile Data Set for Download or QSAR

Found 64 hits of ic50 for UniProtKB: P35218   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
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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PubMed
n/an/a 69n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229834
PNG
(CHEMBL328270)
Show SMILES COC(=O)CCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C9H14N4O5S2/c1-18-7(15)5-3-2-4-6(14)11-8-12-13-9(19-8)20(10,16)17/h2-5H2,1H3,(H2,10,16,17)(H,11,12,14)
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n/an/a 230n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229838
PNG
(CHEMBL88183)
Show SMILES CCCCCOC(=O)CCC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
Show InChI InChI=1S/C12H20N4O5S2/c1-3-4-5-8-21-10(18)7-6-9(17)14-11-16(2)15-12(22-11)23(13,19)20/h3-8H2,1-2H3,(H2,13,19,20)/b14-11+
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n/an/a 310n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229841
PNG
(CHEMBL420799)
Show SMILES CCC(C)OC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C10H16N4O5S2/c1-3-6(2)19-8(16)5-4-7(15)12-9-13-14-10(20-9)21(11,17)18/h6H,3-5H2,1-2H3,(H2,11,17,18)(H,12,13,15)
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n/an/a 370n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229842
PNG
(CHEMBL90119)
Show SMILES CCCCCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C11H18N4O5S2/c1-2-3-4-7-20-9(17)6-5-8(16)13-10-14-15-11(21-10)22(12,18)19/h2-7H2,1H3,(H2,12,18,19)(H,13,14,16)
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n/an/a 390n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50212309
PNG
(CHEMBL91302)
Show SMILES NCCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C7H13N5O3S2/c8-4-2-1-3-5(13)10-6-11-12-7(16-6)17(9,14)15/h1-4,8H2,(H2,9,14,15)(H,10,11,13)
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n/an/a 440n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(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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n/an/a 440n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229847
PNG
(CHEMBL91512)
Show SMILES COC(=O)CCC(=O)\N=c1\sc(nn1C)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-12-7(18-8(11-12)19(9,15)16)10-5(13)3-4-6(14)17-2/h3-4H2,1-2H3,(H2,9,15,16)/b10-7+
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n/an/a 450n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229846
PNG
(CHEMBL264307)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCCCCCC(O)=O)s1
Show InChI InChI=1S/C11H18N4O5S2/c12-22(19,20)11-15-14-10(21-11)13-8(16)6-4-2-1-3-5-7-9(17)18/h1-7H2,(H,17,18)(H2,12,19,20)(H,13,14,16)
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n/an/a 480n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229835
PNG
(CHEMBL90857)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCCC(O)=O)s1
Show InChI InChI=1S/C8H12N4O5S2/c9-19(16,17)8-12-11-7(18-8)10-5(13)3-1-2-4-6(14)15/h1-4H2,(H,14,15)(H2,9,16,17)(H,10,11,13)
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n/an/a 520n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229845
PNG
(CHEMBL91517)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCCC(O)=O)s1
Show InChI InChI=1S/C7H10N4O5S2/c8-18(15,16)7-11-10-6(17-7)9-4(12)2-1-3-5(13)14/h1-3H2,(H,13,14)(H2,8,15,16)(H,9,10,12)
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n/an/a 520n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229839
PNG
(CHEMBL91622)
Show SMILES CCCCCCCCCCCCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C18H32N4O5S2/c1-2-3-4-5-6-7-8-9-10-11-14-27-16(24)13-12-15(23)20-17-21-22-18(28-17)29(19,25)26/h2-14H2,1H3,(H2,19,25,26)(H,20,21,23)
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n/an/a 520n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229836
PNG
(CHEMBL92500)
Show SMILES COC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C7H10N4O5S2/c1-16-5(13)3-2-4(12)9-6-10-11-7(17-6)18(8,14)15/h2-3H2,1H3,(H2,8,14,15)(H,9,10,12)
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n/an/a 550n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50185303
PNG
(CHEMBL88115)
Show SMILES NS(=O)(=O)c1nnc(NC(=O)CCC(O)=O)s1
Show InChI InChI=1S/C6H8N4O5S2/c7-17(14,15)6-10-9-5(16-6)8-3(11)1-2-4(12)13/h1-2H2,(H,12,13)(H2,7,14,15)(H,8,9,11)
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n/an/a 550n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229843
PNG
(CHEMBL91131)
Show SMILES CCOC(=O)CCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-2-17-6(14)4-3-5(13)10-7-11-12-8(18-7)19(9,15)16/h2-4H2,1H3,(H2,9,15,16)(H,10,11,13)
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n/an/a 730n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50155501
PNG
(3-Nitro-benzenesulfonamide | CHEMBL367035)
Show SMILES NS(=O)(=O)c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C6H6N2O4S/c7-13(11,12)6-3-1-2-5(4-6)8(9)10/h1-4H,(H2,7,11,12)
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n/an/a 780n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229844
PNG
(CHEMBL328566)
Show SMILES COC(=O)CCCCCCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C12H20N4O5S2/c1-21-10(18)8-6-4-2-3-5-7-9(17)14-11-15-16-12(22-11)23(13,19)20/h2-8H2,1H3,(H2,13,19,20)(H,14,15,17)
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n/an/a 910n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229837
PNG
(CHEMBL89489)
Show SMILES COC(=O)CCCC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N4O5S2/c1-17-6(14)4-2-3-5(13)10-7-11-12-8(18-7)19(9,15)16/h2-4H2,1H3,(H2,9,15,16)(H,10,11,13)
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n/an/a 910n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50229840
PNG
(CHEMBL329625)
Show SMILES COC(=O)CC(=O)Nc1nnc(s1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N4O5S2/c1-15-4(12)2-3(11)8-5-9-10-6(16-5)17(7,13)14/h2H2,1H3,(H2,7,13,14)(H,8,9,11)
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n/an/a 940n/an/an/an/an/an/a



Istituto Chimico Internazionale Dr. G. Rende

Curated by ChEMBL


Assay Description
Inhibition of Carbonic anhydrase enzyme in rabbits


J Med Chem 35: 2697-703 (1992)


BindingDB Entry DOI: 10.7270/Q2K076G9
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542352
PNG
(CHEMBL4640224)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1cccc(c1)[N+]([O-])=O
Show InChI InChI=1S/C19H16N4O6/c1-28-18-9-13(6-8-19(24)25)5-7-17(18)29-12-14-11-22(21-20-14)15-3-2-4-16(10-15)23(26)27/h2-11H,12H2,1H3,(H,24,25)/b8-6+
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n/an/a 1.10E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542368
PNG
(CHEMBL4642019)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C20H17N3O6/c1-28-18-10-13(3-9-19(24)25)2-8-17(18)29-12-15-11-23(22-21-15)16-6-4-14(5-7-16)20(26)27/h2-11H,12H2,1H3,(H,24,25)(H,26,27)/b9-3+
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n/an/a 1.63E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 1/12/13/14/2/3/4/5A, mitochondrial/5B, mitochondrial/6/7/9


(Homo sapiens (Human))
BDBM50028010
PNG
(AD-810 | CHEBI:10127 | CI-912 | PD-110843 | Zonegr...)
Show SMILES OS(=N)(=O)Cc1noc2ccccc12
Show InChI InChI=1S/C8H8N2O3S/c9-14(11,12)5-7-6-3-1-2-4-8(6)13-10-7/h1-4H,5H2,(H2,9,11,12)
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n/an/a 1.86E+3n/an/an/an/an/an/a



King Saud University

Curated by ChEMBL


Assay Description
Inhibition of carbonic anhydrase (unknown origin)


Bioorg Med Chem 22: 6715-25 (2014)


Article DOI: 10.1016/j.bmc.2014.08.014
BindingDB Entry DOI: 10.7270/Q20Z74W7
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542361
PNG
(CHEMBL4636417)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C19H16N4O6/c1-28-18-10-13(3-9-19(24)25)2-8-17(18)29-12-14-11-22(21-20-14)15-4-6-16(7-5-15)23(26)27/h2-11H,12H2,1H3,(H,24,25)/b9-3+
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n/an/a 1.93E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542365
PNG
(CHEMBL4641337)
Show SMILES COc1ccccc1-n1cc(COc2ccc(\C=C\C(O)=O)cc2OC)nn1
Show InChI InChI=1S/C20H19N3O5/c1-26-17-6-4-3-5-16(17)23-12-15(21-22-23)13-28-18-9-7-14(8-10-20(24)25)11-19(18)27-2/h3-12H,13H2,1-2H3,(H,24,25)/b10-8+
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n/an/a 1.98E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542360
PNG
(CHEMBL4632515)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccccc1[N+]([O-])=O
Show InChI InChI=1S/C19H16N4O6/c1-28-18-10-13(7-9-19(24)25)6-8-17(18)29-12-14-11-22(21-20-14)15-4-2-3-5-16(15)23(26)27/h2-11H,12H2,1H3,(H,24,25)/b9-7+
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n/an/a 1.99E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542359
PNG
(CHEMBL4639923)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccc(Cl)cc1
Show InChI InChI=1S/C19H16ClN3O4/c1-26-18-10-13(3-9-19(24)25)2-8-17(18)27-12-15-11-23(22-21-15)16-6-4-14(20)5-7-16/h2-11H,12H2,1H3,(H,24,25)/b9-3+
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n/an/a 2.17E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542366
PNG
(CHEMBL4641693)
Show SMILES COc1cccc(c1)-n1cc(COc2ccc(\C=C\C(O)=O)cc2OC)nn1
Show InChI InChI=1S/C20H19N3O5/c1-26-17-5-3-4-16(11-17)23-12-15(21-22-23)13-28-18-8-6-14(7-9-20(24)25)10-19(18)27-2/h3-12H,13H2,1-2H3,(H,24,25)/b9-7+
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n/an/a 2.17E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542362
PNG
(CHEMBL4635469)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccccc1C
Show InChI InChI=1S/C20H19N3O4/c1-14-5-3-4-6-17(14)23-12-16(21-22-23)13-27-18-9-7-15(8-10-20(24)25)11-19(18)26-2/h3-12H,13H2,1-2H3,(H,24,25)/b10-8+
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n/an/a 2.36E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM4703
PNG
(4-carboxybenzenesulfonamide 1 | 4-sulfamoylbenzoic...)
Show SMILES NS(=O)(=O)c1ccc(cc1)C(O)=O
Show InChI InChI=1S/C7H7NO4S/c8-13(11,12)6-3-1-5(2-4-6)7(9)10/h1-4H,(H,9,10)(H2,8,11,12)
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n/an/a 2.65E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542363
PNG
(CHEMBL4640484)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1cccc(C)c1
Show InChI InChI=1S/C20H19N3O4/c1-14-4-3-5-17(10-14)23-12-16(21-22-23)13-27-18-8-6-15(7-9-20(24)25)11-19(18)26-2/h3-12H,13H2,1-2H3,(H,24,25)/b9-7+
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n/an/a 2.78E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542358
PNG
(CHEMBL4641866)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1cccc(Cl)c1
Show InChI InChI=1S/C19H16ClN3O4/c1-26-18-9-13(6-8-19(24)25)5-7-17(18)27-12-15-11-23(22-21-15)16-4-2-3-14(20)10-16/h2-11H,12H2,1H3,(H,24,25)/b8-6+
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n/an/a 3.78E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10867
PNG
(4-amino-6-chlorobenzene-1,3-disulfonamide | CHEMBL...)
Show SMILES Nc1cc(Cl)c(cc1S(N)(=O)=O)S(N)(=O)=O
Show InChI InChI=1S/C6H8ClN3O4S2/c7-3-1-4(8)6(16(10,13)14)2-5(3)15(9,11)12/h1-2H,8H2,(H2,9,11,12)(H2,10,13,14)
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n/an/a 4.17E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50025094
PNG
(4-Nitro-benzenesulfonamide | 4-nitrobenzenesulfona...)
Show SMILES NS(=O)(=O)c1ccc(cc1)[N+]([O-])=O
Show InChI InChI=1S/C6H6N2O4S/c7-13(11,12)6-3-1-5(2-4-6)8(9)10/h1-4H,(H2,7,11,12)
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n/an/a 4.20E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10859
PNG
(4-methylbenzene-1-sulfonamide | CHEMBL574 | aromat...)
Show SMILES Cc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C7H9NO2S/c1-6-2-4-7(5-3-6)11(8,9)10/h2-5H,1H3,(H2,8,9,10)
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n/an/a 4.70E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542364
PNG
(CHEMBL4642730)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccc(C)cc1
Show InChI InChI=1S/C20H19N3O4/c1-14-3-7-17(8-4-14)23-12-16(21-22-23)13-27-18-9-5-15(6-10-20(24)25)11-19(18)26-2/h3-12H,13H2,1-2H3,(H,24,25)/b10-6+
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n/an/a 4.97E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542367
PNG
(CHEMBL4635834)
Show SMILES COc1ccc(cc1)-n1cc(COc2ccc(\C=C\C(O)=O)cc2OC)nn1
Show InChI InChI=1S/C20H19N3O5/c1-26-17-7-5-16(6-8-17)23-12-15(21-22-23)13-28-18-9-3-14(4-10-20(24)25)11-19(18)27-2/h3-12H,13H2,1-2H3,(H,24,25)/b10-4+
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n/an/a 6.67E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10863
PNG
(4-Amino-3-chlorobenzenesulfonamide | 4-amino-3-chl...)
Show SMILES Nc1ccc(cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C6H7ClN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)
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n/an/a 7.40E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10864
PNG
(4-Amino-3-bromobenzenesulfonamide | 4-amino-3-brom...)
Show SMILES Nc1ccc(cc1Br)S(N)(=O)=O
Show InChI InChI=1S/C6H7BrN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)
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n/an/a 7.60E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10858
PNG
(4-hydrazinylbenzene-1-sulfonamide | CHEMBL7204 | a...)
Show SMILES NNc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C6H9N3O2S/c7-9-5-1-3-6(4-2-5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)
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n/an/a 7.70E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542356
PNG
(CHEMBL4641975)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccc(F)cc1
Show InChI InChI=1S/C19H16FN3O4/c1-26-18-10-13(3-9-19(24)25)2-8-17(18)27-12-15-11-23(22-21-15)16-6-4-14(20)5-7-16/h2-11H,12H2,1H3,(H,24,25)/b9-3+
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n/an/a 8.32E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50155502
PNG
(4-Thiocyanato-benzenesulfonamide | CHEMBL363086)
Show SMILES NS(=O)(=O)c1ccc(SC#N)cc1
Show InChI InChI=1S/C7H6N2O2S2/c8-5-12-6-1-3-7(4-2-6)13(9,10)11/h1-4H,(H2,9,10,11)
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n/an/a 8.60E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50214744
PNG
((2E)-3-(4-hydroxy-3-methoxyphenyl)prop-2-enoic aci...)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1O
Show InChI InChI=1S/C10H10O4/c1-14-9-6-7(2-4-8(9)11)3-5-10(12)13/h2-6,11H,1H3,(H,12,13)/b5-3+
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n/an/a 8.86E+3n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10876
PNG
(4-(hydroxymethyl)benzene-1-sulfonamide | CHEMBL691...)
Show SMILES NS(=O)(=O)c1ccc(CO)cc1
Show InChI InChI=1S/C7H9NO3S/c8-12(10,11)7-3-1-6(5-9)2-4-7/h1-4,9H,5H2,(H2,8,10,11)
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n/an/a 9.30E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10862
PNG
(4-Amino-3-fluorobenzenesulfonamide | 4-amino-3-flu...)
Show SMILES Nc1ccc(cc1F)S(N)(=O)=O
Show InChI InChI=1S/C6H7FN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)
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n/an/a 9.30E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10866
PNG
(4-amino-6-(trifluoromethyl)benzene-1,3-disulfonami...)
Show SMILES Nc1cc(c(cc1S(N)(=O)=O)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C7H8F3N3O4S2/c8-7(9,10)3-1-4(11)6(19(13,16)17)2-5(3)18(12,14)15/h1-2H,11H2,(H2,12,14,15)(H2,13,16,17)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10865
PNG
(4-Amino-3-iodobenzenesulfonamide | 4-amino-3-iodob...)
Show SMILES Nc1ccc(cc1I)S(N)(=O)=O
Show InChI InChI=1S/C6H7IN2O2S/c7-5-3-4(12(9,10)11)1-2-6(5)8/h1-3H,8H2,(H2,9,10,11)
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n/an/a 9.40E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50296250
PNG
((S,Z)-3-(2-hydroxy-5-(1-hydroxy-3-methylbutyl)-4-m...)
Show SMILES COc1cc(O)c(\C=C/C(O)=O)cc1[C@@H](O)CC(C)C |r|
Show InChI InChI=1S/C15H20O5/c1-9(2)6-13(17)11-7-10(4-5-15(18)19)12(16)8-14(11)20-3/h4-5,7-9,13,16-17H,6H2,1-3H3,(H,18,19)/b5-4-/t13-/m0/s1
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n/an/a 9.60E+3n/an/an/an/an/an/a



University of Tampere and Tampere University Hospital

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A by stopped flow CO2 hydration assay


Bioorg Med Chem Lett 19: 4102-6 (2009)


Article DOI: 10.1016/j.bmcl.2009.06.002
BindingDB Entry DOI: 10.7270/Q23778S7
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM10879
PNG
(2-Hydrazinobenzenesulfonamide | 2-hydrazinylbenzen...)
Show SMILES NNc1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C6H9N3O2S/c7-9-5-3-1-2-4-6(5)12(8,10)11/h1-4,9H,7H2,(H2,8,10,11)
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n/an/a 9.60E+3n/an/an/an/an/an/a



Università degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibitory concentration against human cystolic isozyme V of Carbonic anhydrase


Bioorg Med Chem Lett 14: 5703-7 (2004)


Article DOI: 10.1016/j.bmcl.2004.07.085
BindingDB Entry DOI: 10.7270/Q23N22VW
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542354
PNG
(CHEMBL4647534)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1ccccc1F
Show InChI InChI=1S/C19H16FN3O4/c1-26-18-10-13(7-9-19(24)25)6-8-17(18)27-12-14-11-23(22-21-14)16-5-3-2-4-15(16)20/h2-11H,12H2,1H3,(H,24,25)/b9-7+
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n/an/a 1.03E+4n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
Carbonic anhydrase 5A, mitochondrial


(Homo sapiens (Human))
BDBM50542355
PNG
(CHEMBL4637712)
Show SMILES COc1cc(\C=C\C(O)=O)ccc1OCc1cn(nn1)-c1cccc(F)c1
Show InChI InChI=1S/C19H16FN3O4/c1-26-18-9-13(6-8-19(24)25)5-7-17(18)27-12-15-11-23(22-21-15)16-4-2-3-14(20)10-16/h2-11H,12H2,1H3,(H,24,25)/b8-6+
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n/an/a 1.14E+4n/an/an/an/an/an/a



Jamia Millia Islamia

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 5A using p-nitrophenyl acetate as substrate by UV-VIS spectrophotometric analysis


Bioorg Med Chem 28: (2020)


Article DOI: 10.1016/j.bmc.2020.115424
BindingDB Entry DOI: 10.7270/Q22Z192W
More data for this
Ligand-Target Pair
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