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PubMed code 12565948

Compile data set for download or QSAR
Found 120 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 2


(Homo sapiens (Human))
BDBM50079051
PNG
(6-[2-(4-Sulfamoyl-phenyl)-ethylcarbamoyl]-pyridine...)
Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C15H15N3O5S/c16-24(22,23)11-6-4-10(5-7-11)8-9-17-14(19)12-2-1-3-13(18-12)15(20)21/h1-7H,8-9H2,(H,17,19)(H,20,21)(H2,16,22,23)
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7n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079067
PNG
(6-(2-Fluoro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(F)c1
Show InChI InChI=1S/C13H10FN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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8n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079057
PNG
(4-Chloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1cc(c(cc1Cl)N1C(=O)c2cccnc2C1=O)S(N)(=O)=O
Show InChI InChI=1S/C13H9ClN4O6S2/c14-7-4-8(10(26(16,23)24)5-9(7)25(15,21)22)18-12(19)6-2-1-3-17-11(6)13(18)20/h1-5H,(H2,15,21,22)(H2,16,23,24)
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9n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079052
PNG
(6-(5-Chloro-2,4-disulfamoyl-phenylcarbamoyl)-pyrid...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H11ClN4O7S2/c14-6-4-9(11(27(16,24)25)5-10(6)26(15,22)23)18-12(19)7-2-1-3-8(17-7)13(20)21/h1-5H,(H,18,19)(H,20,21)(H2,15,22,23)(H2,16,24,25)
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9n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079027
PNG
(4-[2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-...)
Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O4S/c16-23(21,22)11-5-3-10(4-6-11)7-9-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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9n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079030
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(F)c1
Show InChI InChI=1S/C13H8FN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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10n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079063
PNG
(6-(2,3-Dichloro-4,6-disulfamoyl-phenylcarbamoyl)-p...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H10Cl2N4O7S2/c14-9-7(27(16,23)24)4-8(28(17,25)26)11(10(9)15)19-12(20)5-2-1-3-6(18-5)13(21)22/h1-4H,(H,19,20)(H,21,22)(H2,16,23,24)(H2,17,25,26)
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10n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079041
PNG
(4,5-Dichloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-...)
Show SMILES NS(=O)(=O)c1cc(c(N2C(=O)c3cccnc3C2=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H8Cl2N4O6S2/c14-8-6(26(16,22)23)4-7(27(17,24)25)11(9(8)15)19-12(20)5-2-1-3-18-10(5)13(19)21/h1-4H,(H2,16,22,23)(H2,17,24,25)
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12n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50222603
PNG
(CHEMBL141112)
Show SMILES NS(=O)(=O)c1ccc(CCON2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O5S/c16-24(21,22)11-5-3-10(4-6-11)7-9-23-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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15n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50222618
PNG
(CHEMBL342368)
Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H12N2O6S/c15-23(20,21)10-6-4-9(5-7-10)8-22-14(19)12-3-1-2-11(16-12)13(17)18/h1-7H,8H2,(H,17,18)(H2,15,20,21)
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20n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079038
PNG
(6-(2-Chloro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C13H10ClN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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25n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079043
PNG
(4-Amino-5,6-dichloro-benzene-1,3-disulfonic acid d...)
Show SMILES Nc1c(Cl)c(Cl)c(cc1S(N)(=O)=O)S(N)(=O)=O
Show InChI InChI=1S/C6H7Cl2N3O4S2/c7-4-2(16(10,12)13)1-3(17(11,14)15)6(9)5(4)8/h1H,9H2,(H2,10,12,13)(H2,11,14,15)
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28n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079060
PNG
(6-(2-Bromo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Br)c1
Show InChI InChI=1S/C13H10BrN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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30n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079046
PNG
(6-(2-Iodo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(I)c1
Show InChI InChI=1S/C13H10IN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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31n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079032
PNG
(3-Bromo-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]pyr...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Br)c1
Show InChI InChI=1S/C13H8BrN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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31n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079053
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(I)c1
Show InChI InChI=1S/C13H8IN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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33n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079065
PNG
(6-(4-Sulfamoyl-benzylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(CNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H13N3O5S/c15-23(21,22)10-6-4-9(5-7-10)8-16-13(18)11-2-1-3-12(17-11)14(19)20/h1-7H,8H2,(H,16,18)(H,19,20)(H2,15,21,22)
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36n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079051
PNG
(6-[2-(4-Sulfamoyl-phenyl)-ethylcarbamoyl]-pyridine...)
Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C15H15N3O5S/c16-24(22,23)11-6-4-10(5-7-11)8-9-17-14(19)12-2-1-3-13(18-12)15(20)21/h1-7H,8-9H2,(H,17,19)(H,20,21)(H2,16,22,23)
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40n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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40n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM152638
PNG
(4-(1,3-Dioxoisoindolin-2-yl)benzenesulphonamide (1...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C14H10N2O4S/c15-21(19,20)10-7-5-9(6-8-10)16-13(17)11-3-1-2-4-12(11)14(16)18/h1-8H,(H2,15,19,20)
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42n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079067
PNG
(6-(2-Fluoro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(F)c1
Show InChI InChI=1S/C13H10FN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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44n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079036
PNG
(3-Chloro-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Cl)c1
Show InChI InChI=1S/C13H8ClN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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44n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079030
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(F)c1
Show InChI InChI=1S/C13H8FN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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46n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079052
PNG
(6-(5-Chloro-2,4-disulfamoyl-phenylcarbamoyl)-pyrid...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H11ClN4O7S2/c14-6-4-9(11(27(16,24)25)5-10(6)26(15,22)23)18-12(19)7-2-1-3-8(17-7)13(20)21/h1-5H,(H,18,19)(H,20,21)(H2,15,22,23)(H2,16,24,25)
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48n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079027
PNG
(4-[2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-...)
Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O4S/c16-23(21,22)11-5-3-10(4-6-11)7-9-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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54n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079063
PNG
(6-(2,3-Dichloro-4,6-disulfamoyl-phenylcarbamoyl)-p...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H10Cl2N4O7S2/c14-9-7(27(16,23)24)4-8(28(17,25)26)11(10(9)15)19-12(20)5-2-1-3-6(18-5)13(21)22/h1-4H,(H,19,20)(H,21,22)(H2,16,23,24)(H2,17,25,26)
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55n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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60n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079057
PNG
(4-Chloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1cc(c(cc1Cl)N1C(=O)c2cccnc2C1=O)S(N)(=O)=O
Show InChI InChI=1S/C13H9ClN4O6S2/c14-7-4-8(10(26(16,23)24)5-9(7)25(15,21)22)18-12(19)6-2-1-3-17-11(6)13(18)20/h1-5H,(H2,15,21,22)(H2,16,23,24)
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60n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079046
PNG
(6-(2-Iodo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(I)c1
Show InChI InChI=1S/C13H10IN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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62n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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66n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079038
PNG
(6-(2-Chloro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C13H10ClN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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66n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079041
PNG
(4,5-Dichloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-...)
Show SMILES NS(=O)(=O)c1cc(c(N2C(=O)c3cccnc3C2=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H8Cl2N4O6S2/c14-8-6(26(16,22)23)4-7(27(17,24)25)11(9(8)15)19-12(20)5-2-1-3-18-10(5)13(19)21/h1-4H,(H2,16,22,23)(H2,17,24,25)
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69n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079060
PNG
(6-(2-Bromo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Br)c1
Show InChI InChI=1S/C13H10BrN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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69n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079053
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(I)c1
Show InChI InChI=1S/C13H8IN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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70n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079065
PNG
(6-(4-Sulfamoyl-benzylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(CNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H13N3O5S/c15-23(21,22)10-6-4-9(5-7-10)8-16-13(18)11-2-1-3-12(17-11)14(19)20/h1-7H,8H2,(H,16,18)(H,19,20)(H2,15,21,22)
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70n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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70n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079032
PNG
(3-Bromo-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]pyr...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Br)c1
Show InChI InChI=1S/C13H8BrN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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75n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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75n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM152638
PNG
(4-(1,3-Dioxoisoindolin-2-yl)benzenesulphonamide (1...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C14H10N2O4S/c15-21(19,20)10-7-5-9(6-8-10)16-13(17)11-3-1-2-4-12(11)14(16)18/h1-8H,(H2,15,19,20)
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79n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079036
PNG
(3-Chloro-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Cl)c1
Show InChI InChI=1S/C13H8ClN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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79n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50222603
PNG
(CHEMBL141112)
Show SMILES NS(=O)(=O)c1ccc(CCON2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O5S/c16-24(21,22)11-5-3-10(4-6-11)7-9-23-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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105n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10877
PNG
(4-(2-hydroxyethyl)benzene-1-sulfonamide | CHEMBL67...)
Show SMILES NS(=O)(=O)c1ccc(CCO)cc1
Show InChI InChI=1S/C8H11NO3S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2,(H2,9,11,12)
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110n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase 2


(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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110n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50222618
PNG
(CHEMBL342368)
Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H12N2O6S/c15-23(20,21)10-6-4-9(5-7-10)8-22-14(19)12-3-1-2-11(16-12)13(17)18/h1-7H,8H2,(H,17,18)(H2,15,20,21)
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120n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079028
PNG
(6-(4-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-6-4-8(5-7-9)15-12(17)10-2-1-3-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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121n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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124n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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125n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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132n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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132n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079028
PNG
(6-(4-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-6-4-8(5-7-9)15-12(17)10-2-1-3-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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150n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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150n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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159n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10861
PNG
(4-(2-aminoethyl)benzene-1-sulfonamide | CHEMBL7087...)
Show SMILES NCCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)
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160n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (crystal)
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10860
PNG
(4-(aminomethyl)benzene-1-sulfonamide | CHEMBL419 |...)
Show SMILES NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C7H10N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,5,8H2,(H2,9,10,11)
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170n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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170n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079043
PNG
(4-Amino-5,6-dichloro-benzene-1,3-disulfonic acid d...)
Show SMILES Nc1c(Cl)c(Cl)c(cc1S(N)(=O)=O)S(N)(=O)=O
Show InChI InChI=1S/C6H7Cl2N3O4S2/c7-4-2(16(10,12)13)1-3(17(11,14)15)6(9)5(4)8/h1H,9H2,(H2,10,12,13)(H2,11,14,15)
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174n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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180n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079047
PNG
(3-Amino-benzenesulfonamide | 3-aminobenzenesulfona...)
Show SMILES Nc1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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240n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079050
PNG
(6-(3-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1cccc(NC(=O)c2cccc(n2)C(O)=O)c1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-4-1-3-8(7-9)15-12(17)10-5-2-6-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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242n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079029
PNG
(6-(2-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccccc1NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)11-7-2-1-4-8(11)16-12(17)9-5-3-6-10(15-9)13(18)19/h1-7H,(H,16,17)(H,18,19)(H2,14,20,21)
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260n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079061
PNG
(2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccccc1N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)10-6-2-1-5-9(10)16-12(17)8-4-3-7-15-11(8)13(16)18/h1-7H,(H2,14,19,20)
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280n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079050
PNG
(6-(3-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1cccc(NC(=O)c2cccc(n2)C(O)=O)c1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-4-1-3-8(7-9)15-12(17)10-5-2-6-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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284n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10855
PNG
(2-aminobenzene-1-sulfonamide | CHEMBL6705 | US1017...)
Show SMILES Nc1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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295n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079029
PNG
(6-(2-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccccc1NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)11-7-2-1-4-8(11)16-12(17)9-5-3-6-10(15-9)13(18)19/h1-7H,(H,16,17)(H,18,19)(H2,14,20,21)
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299n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM10857
PNG
(4-aminobenzene-1-sulfonamide | CHEMBL21 | Sulfanil...)
Show SMILES Nc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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300n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
3D
3D Structure (docked)
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079054
PNG
(6-[N'-(4-Sulfamoyl-phenyl)-hydrazinocarbonyl]-pyri...)
Show SMILES NS(=O)(=O)c1ccc(NNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H12N4O5S/c14-23(21,22)9-6-4-8(5-7-9)16-17-12(18)10-2-1-3-11(15-10)13(19)20/h1-7,16H,(H,17,18)(H,19,20)(H2,14,21,22)
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304n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079045
PNG
(3-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1cccc(c1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-4-1-3-8(7-9)16-12(17)10-5-2-6-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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305n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079061
PNG
(2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccccc1N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)10-6-2-1-5-9(10)16-12(17)8-4-3-7-15-11(8)13(16)18/h1-7H,(H2,14,19,20)
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310n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(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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320n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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320n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079054
PNG
(6-[N'-(4-Sulfamoyl-phenyl)-hydrazinocarbonyl]-pyri...)
Show SMILES NS(=O)(=O)c1ccc(NNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H12N4O5S/c14-23(21,22)9-6-4-8(5-7-9)16-17-12(18)10-2-1-3-11(15-10)13(19)20/h1-7,16H,(H,17,18)(H,19,20)(H2,14,21,22)
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370n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079052
PNG
(6-(5-Chloro-2,4-disulfamoyl-phenylcarbamoyl)-pyrid...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)cc1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H11ClN4O7S2/c14-6-4-9(11(27(16,24)25)5-10(6)26(15,22)23)18-12(19)7-2-1-3-8(17-7)13(20)21/h1-5H,(H,18,19)(H,20,21)(H2,15,22,23)(H2,16,24,25)
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370n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50079045
PNG
(3-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1cccc(c1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-4-1-3-8(7-9)16-12(17)10-5-2-6-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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400n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase II (CAII)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM10877
PNG
(4-(2-hydroxyethyl)benzene-1-sulfonamide | CHEMBL67...)
Show SMILES NS(=O)(=O)c1ccc(CCO)cc1
Show InChI InChI=1S/C8H11NO3S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2,(H2,9,11,12)
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449n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079063
PNG
(6-(2,3-Dichloro-4,6-disulfamoyl-phenylcarbamoyl)-p...)
Show SMILES NS(=O)(=O)c1cc(c(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H10Cl2N4O7S2/c14-9-7(27(16,23)24)4-8(28(17,25)26)11(10(9)15)19-12(20)5-2-1-3-6(18-5)13(21)22/h1-4H,(H,19,20)(H,21,22)(H2,16,23,24)(H2,17,25,26)
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450n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079041
PNG
(4,5-Dichloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-...)
Show SMILES NS(=O)(=O)c1cc(c(N2C(=O)c3cccnc3C2=O)c(Cl)c1Cl)S(N)(=O)=O
Show InChI InChI=1S/C13H8Cl2N4O6S2/c14-8-6(26(16,22)23)4-7(27(17,24)25)11(9(8)15)19-12(20)5-2-1-3-18-10(5)13(19)21/h1-4H,(H2,16,22,23)(H2,17,24,25)
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500n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079067
PNG
(6-(2-Fluoro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(F)c1
Show InChI InChI=1S/C13H10FN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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510n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079030
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(F)c1
Show InChI InChI=1S/C13H8FN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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540n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079051
PNG
(6-[2-(4-Sulfamoyl-phenyl)-ethylcarbamoyl]-pyridine...)
Show SMILES NS(=O)(=O)c1ccc(CCNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C15H15N3O5S/c16-24(22,23)11-6-4-10(5-7-11)8-9-17-14(19)12-2-1-3-13(18-12)15(20)21/h1-7H,8-9H2,(H,17,19)(H,20,21)(H2,16,22,23)
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550n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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560n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079060
PNG
(6-(2-Bromo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Br)c1
Show InChI InChI=1S/C13H10BrN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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575n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079038
PNG
(6-(2-Chloro-4-sulfamoyl-phenylcarbamoyl)-pyridine-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(Cl)c1
Show InChI InChI=1S/C13H10ClN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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599n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079057
PNG
(4-Chloro-6-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1cc(c(cc1Cl)N1C(=O)c2cccnc2C1=O)S(N)(=O)=O
Show InChI InChI=1S/C13H9ClN4O6S2/c14-7-4-8(10(26(16,23)24)5-9(7)25(15,21)22)18-12(19)6-2-1-3-17-11(6)13(18)20/h1-5H,(H2,15,21,22)(H2,16,23,24)
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600n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079046
PNG
(6-(2-Iodo-4-sulfamoyl-phenylcarbamoyl)-pyridine-2-...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)c(I)c1
Show InChI InChI=1S/C13H10IN3O5S/c14-8-6-7(23(15,21)22)4-5-9(8)17-12(18)10-2-1-3-11(16-10)13(19)20/h1-6H,(H,17,18)(H,19,20)(H2,15,21,22)
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600n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079032
PNG
(3-Bromo-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]pyr...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Br)c1
Show InChI InChI=1S/C13H8BrN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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605n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079053
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(I)c1
Show InChI InChI=1S/C13H8IN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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609n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079036
PNG
(3-Chloro-4-(5,7-dioxo-5,7-dihydro-pyrrolo[3,4-b]py...)
Show SMILES NS(=O)(=O)c1ccc(N2C(=O)c3cccnc3C2=O)c(Cl)c1
Show InChI InChI=1S/C13H8ClN3O4S/c14-9-6-7(22(15,20)21)3-4-10(9)17-12(18)8-2-1-5-16-11(8)13(17)19/h1-6H,(H2,15,20,21)
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620n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079027
PNG
(4-[2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-...)
Show SMILES NS(=O)(=O)c1ccc(CCN2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O4S/c16-23(21,22)11-5-3-10(4-6-11)7-9-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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845n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079065
PNG
(6-(4-Sulfamoyl-benzylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(CNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H13N3O5S/c15-23(21,22)10-6-4-9(5-7-10)8-16-13(18)11-2-1-3-12(17-11)14(19)20/h1-7H,8H2,(H,16,18)(H,19,20)(H2,15,21,22)
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860n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM152638
PNG
(4-(1,3-Dioxoisoindolin-2-yl)benzenesulphonamide (1...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2ccccc2C1=O
Show InChI InChI=1S/C14H10N2O4S/c15-21(19,20)10-7-5-9(6-8-10)16-13(17)11-3-1-2-4-12(11)14(16)18/h1-8H,(H2,15,19,20)
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1.04E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM10855
PNG
(2-aminobenzene-1-sulfonamide | CHEMBL6705 | US1017...)
Show SMILES Nc1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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1.31E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50222603
PNG
(CHEMBL141112)
Show SMILES NS(=O)(=O)c1ccc(CCON2C(=O)c3cccnc3C2=O)cc1
Show InChI InChI=1S/C15H13N3O5S/c16-24(21,22)11-5-3-10(4-6-11)7-9-23-18-14(19)12-2-1-8-17-13(12)15(18)20/h1-6,8H,7,9H2,(H2,16,21,22)
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2.00E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50222618
PNG
(CHEMBL342368)
Show SMILES NS(=O)(=O)c1ccc(COC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C14H12N2O6S/c15-23(20,21)10-6-4-9(5-7-10)8-22-14(19)12-3-1-2-11(16-12)13(17)18/h1-7H,8H2,(H,17,18)(H2,15,20,21)
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2.04E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM50079047
PNG
(3-Amino-benzenesulfonamide | 3-aminobenzenesulfona...)
Show SMILES Nc1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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2.20E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM10861
PNG
(4-(2-aminoethyl)benzene-1-sulfonamide | CHEMBL7087...)
Show SMILES NCCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)
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2.45E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM10860
PNG
(4-(aminomethyl)benzene-1-sulfonamide | CHEMBL419 |...)
Show SMILES NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C7H10N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,5,8H2,(H2,9,10,11)
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2.80E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
BDBM10857
PNG
(4-aminobenzene-1-sulfonamide | CHEMBL21 | Sulfanil...)
Show SMILES Nc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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3.00E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Bos taurus (bovine))
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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3.22E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of bovine carbonic anhydrase IV (CAIV)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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6.00E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079043
PNG
(4-Amino-5,6-dichloro-benzene-1,3-disulfonic acid d...)
Show SMILES Nc1c(Cl)c(Cl)c(cc1S(N)(=O)=O)S(N)(=O)=O
Show InChI InChI=1S/C6H7Cl2N3O4S2/c7-4-2(16(10,12)13)1-3(17(11,14)15)6(9)5(4)8/h1H,9H2,(H2,10,12,13)(H2,11,14,15)
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6.10E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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6.50E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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8.30E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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8.40E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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9.80E+3n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079028
PNG
(6-(4-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccc(NC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-6-4-8(5-7-9)15-12(17)10-2-1-3-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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1.50E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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1.55E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079039
PNG
(4-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccc(cc1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-5-3-8(4-6-9)16-12(17)10-2-1-7-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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1.55E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM10877
PNG
(4-(2-hydroxyethyl)benzene-1-sulfonamide | CHEMBL67...)
Show SMILES NS(=O)(=O)c1ccc(CCO)cc1
Show InChI InChI=1S/C8H11NO3S/c9-13(11,12)8-3-1-7(2-4-8)5-6-10/h1-4,10H,5-6H2,(H2,9,11,12)
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1.80E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079050
PNG
(6-(3-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1cccc(NC(=O)c2cccc(n2)C(O)=O)c1
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)9-4-1-3-8(7-9)15-12(17)10-5-2-6-11(16-10)13(18)19/h1-7H,(H,15,17)(H,18,19)(H2,14,20,21)
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1.85E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079029
PNG
(6-(2-Sulfamoyl-phenylcarbamoyl)-pyridine-2-carboxy...)
Show SMILES NS(=O)(=O)c1ccccc1NC(=O)c1cccc(n1)C(O)=O
Show InChI InChI=1S/C13H11N3O5S/c14-22(20,21)11-7-2-1-4-8(11)16-12(17)9-5-3-6-10(15-9)13(18)19/h1-7H,(H,16,17)(H,18,19)(H2,14,20,21)
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2.00E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079045
PNG
(3-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1cccc(c1)N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)9-4-1-3-8(7-9)16-12(17)10-5-2-6-15-11(10)13(16)18/h1-7H,(H2,14,19,20)
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2.00E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079054
PNG
(6-[N'-(4-Sulfamoyl-phenyl)-hydrazinocarbonyl]-pyri...)
Show SMILES NS(=O)(=O)c1ccc(NNC(=O)c2cccc(n2)C(O)=O)cc1
Show InChI InChI=1S/C13H12N4O5S/c14-23(21,22)9-6-4-8(5-7-9)16-17-12(18)10-2-1-3-11(15-10)13(19)20/h1-7,16H,(H,17,18)(H,19,20)(H2,14,21,22)
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2.06E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM10861
PNG
(4-(2-aminoethyl)benzene-1-sulfonamide | CHEMBL7087...)
Show SMILES NCCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C8H12N2O2S/c9-6-5-7-1-3-8(4-2-7)13(10,11)12/h1-4H,5-6,9H2,(H2,10,11,12)
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2.10E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079061
PNG
(2-(5,7-Dioxo-5,7-dihydro-pyrrolo[3,4-b]pyridin-6-y...)
Show SMILES NS(=O)(=O)c1ccccc1N1C(=O)c2cccnc2C1=O
Show InChI InChI=1S/C13H9N3O4S/c14-21(19,20)10-6-2-1-5-9(10)16-12(17)8-4-3-7-15-11(8)13(16)18/h1-7H,(H2,14,19,20)
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2.10E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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2.40E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM10860
PNG
(4-(aminomethyl)benzene-1-sulfonamide | CHEMBL419 |...)
Show SMILES NCc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C7H10N2O2S/c8-5-6-1-3-7(4-2-6)12(9,10)11/h1-4H,5,8H2,(H2,9,10,11)
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2.50E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50079047
PNG
(3-Amino-benzenesulfonamide | 3-aminobenzenesulfona...)
Show SMILES Nc1cccc(c1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-2-1-3-6(4-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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2.50E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM10857
PNG
(4-aminobenzene-1-sulfonamide | CHEMBL21 | Sulfanil...)
Show SMILES Nc1ccc(cc1)S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-1-3-6(4-2-5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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2.80E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM10855
PNG
(2-aminobenzene-1-sulfonamide | CHEMBL6705 | US1017...)
Show SMILES Nc1ccccc1S(N)(=O)=O
Show InChI InChI=1S/C6H8N2O2S/c7-5-3-1-2-4-6(5)11(8,9)10/h1-4H,7H2,(H2,8,9,10)
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4.54E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(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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7.85E+4n/an/an/an/an/an/an/an/a



A.P.S. University

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase I (CAI)


Bioorg Med Chem Lett 13: 447-53 (2003)


Article DOI: 10.1016/s0960-894x(02)00954-x
BindingDB Entry DOI: 10.7270/Q2668GC9
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%