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Compile Data Set for Download or QSAR

Found 15 hits of ph data with Target = 'Carbonic Anhydrase IV'   
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 IV


(Bos taurus (bovine))
BDBM14722
PNG
(1-N-[5-Sulfamoyl-1,3,4-thiadiazol-2-yl-(aminosulfo...)
Show SMILES Cc1cc(cc(C)[n+]1-c1ccc(cc1)S(=O)(=O)Nc1nnc(s1)S(N)(=O)=O)-c1ccccc1
Show InChI InChI=1S/C21H20N5O4S3/c1-14-12-17(16-6-4-3-5-7-16)13-15(2)26(14)18-8-10-19(11-9-18)33(29,30)25-20-23-24-21(31-20)32(22,27)28/h3-13H,1-2H3,(H,23,25)(H2,22,27,28)/q+1
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Article
PubMed
2 -48.8n/an/an/an/an/a7.420



Università degli Studi di Firenze



Assay Description
The initial rates of 4-nitrophenylacetate hydrolysis catalysed by different CA isozymes were monitored spectrophotometrically at 400nm with a Cary 3 ...


J Enzyme Inhib Med Chem 19: 269-73 (2004)


Article DOI: 10.1080/14756360410001689559
BindingDB Entry DOI: 10.7270/Q20C4TBB
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM50141779
PNG
(2,6-Dimethyl-4-phenyl-1-(4-sulfamoyl-phenyl)-pyrid...)
Show SMILES Cc1cc(cc(C)[n+]1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1
Show InChI InChI=1S/C19H19N2O2S/c1-14-12-17(16-6-4-3-5-7-16)13-15(2)21(14)18-8-10-19(11-9-18)24(20,22)23/h3-13H,1-2H3,(H2,20,22,23)/q+1
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PubMed
29 -42.3n/an/an/an/an/a7.420



Università degli Studi di Firenze



Assay Description
The initial rates of 4-nitrophenylacetate hydrolysis catalysed by different CA isozymes were monitored spectrophotometrically at 400nm with a Cary 3 ...


J Enzyme Inhib Med Chem 19: 269-73 (2004)


Article DOI: 10.1080/14756360410001689559
BindingDB Entry DOI: 10.7270/Q20C4TBB
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85563
PNG
(2-[4-(4-Bromophenylsulfonyl)-Phenyl}-thiazole-4-yl...)
Show SMILES NS(=O)(=O)NCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C16H14BrN3O4S3/c17-12-3-7-15(8-4-12)26(21,22)14-5-1-11(2-6-14)16-20-13(10-25-16)9-19-27(18,23)24/h1-8,10,19H,9H2,(H2,18,23,24)
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50 -41.7n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85566
PNG
(2-[4-(4-Bromophenylsulfonyl)-Phenyl}-thiazole-4-yl...)
Show SMILES NS(=O)(=O)OCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccc(Br)cc1
Show InChI InChI=1S/C16H13BrN2O5S3/c17-12-3-7-15(8-4-12)26(20,21)14-5-1-11(2-6-14)16-19-13(10-25-16)9-24-27(18,22)23/h1-8,10H,9H2,(H2,18,22,23)
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54 -41.5n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85562
PNG
(2-[4-(4-Chlorophenylsulfonyl)-Phenyl}-thiazole-4-y...)
Show SMILES NS(=O)(=O)NCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H14ClN3O4S3/c17-12-3-7-15(8-4-12)26(21,22)14-5-1-11(2-6-14)16-20-13(10-25-16)9-19-27(18,23)24/h1-8,10,19H,9H2,(H2,18,23,24)
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65 -41.0n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85565
PNG
(2-[4-(4-Chlorophenylsulfonyl)-Phenyl}-thiazole-4-y...)
Show SMILES NS(=O)(=O)OCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C16H13ClN2O5S3/c17-12-3-7-15(8-4-12)26(20,21)14-5-1-11(2-6-14)16-19-13(10-25-16)9-24-27(18,22)23/h1-8,10H,9H2,(H2,18,22,23)
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66 -41.0n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
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
70 -40.8n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85561
PNG
(2-[4-(Phenylsulfonyl)-Phenyl}-thiazole-4-yl-methyl...)
Show SMILES NS(=O)(=O)NCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H15N3O4S3/c17-26(22,23)18-10-13-11-24-16(19-13)12-6-8-15(9-7-12)25(20,21)14-4-2-1-3-5-14/h1-9,11,18H,10H2,(H2,17,22,23)
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83 -40.4n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85564
PNG
(2-[4-(Phenylsulfonyl)-Phenyl}-thiazole-4-yl-methyl...)
Show SMILES NS(=O)(=O)OCc1csc(n1)-c1ccc(cc1)S(=O)(=O)c1ccccc1
Show InChI InChI=1S/C16H14N2O5S3/c17-26(21,22)23-10-13-11-24-16(18-13)12-6-8-15(9-7-12)25(19,20)14-4-2-1-3-5-14/h1-9,11H,10H2,(H2,17,21,22)
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87 -40.3n/an/an/an/an/a7.425



Università degli Studi



Assay Description
Inhibition assay using human Carbonic anhydrase I and II and bovine carbonic anhydrase IV.


J Enzym Inhib 16: 351-8 (2001)


BindingDB Entry DOI: 10.7270/Q2K9363Z
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM85660
PNG
(Sulfonamide, 6)
Show SMILES CC[N+](CC)(CC)CC(=O)Nc1nnc(s1)S(=O)ON
Show InChI InChI=1S/C10H19N5O3S2/c1-4-15(5-2,6-3)7-8(16)12-9-13-14-10(19-9)20(17)18-11/h4-7,11H2,1-3H3/p+1
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Article
PubMed
170 -38.0n/an/an/an/an/a7.420



Università degli Studi di Firenze



Assay Description
The initial rates of 4-nitrophenylacetate hydrolysis catalysed by different CA isozymes were monitored spectrophotometrically at 400nm with a Cary 3 ...


J Enzyme Inhib Med Chem 19: 269-73 (2004)


Article DOI: 10.1080/14756360410001689559
BindingDB Entry DOI: 10.7270/Q20C4TBB
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM13063
PNG
(4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzene-1-sul...)
Show SMILES Cc1onc(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1
Show InChI InChI=1S/C16H14N2O3S/c1-11-15(12-7-9-14(10-8-12)22(17,19)20)16(18-21-11)13-5-3-2-4-6-13/h2-10H,1H3,(H2,17,19,20)
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Article
PubMed
n/an/a 340n/an/an/an/a7.425



University of Marburg



Assay Description
Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...


J Med Chem 47: 550-7 (2004)


Article DOI: 10.1021/jm030912m
BindingDB Entry DOI: 10.7270/Q2W957DZ
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM11639
PNG
(4-[5-(4-methylphenyl)-3-(trifluoromethyl)-1H-pyraz...)
Show SMILES Cc1ccc(cc1)-c1cc(nn1-c1ccc(cc1)S(N)(=O)=O)C(F)(F)F
Show InChI InChI=1S/C17H14F3N3O2S/c1-11-2-4-12(5-3-11)15-10-16(17(18,19)20)22-23(15)13-6-8-14(9-7-13)26(21,24)25/h2-10H,1H3,(H2,21,24,25)
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n/an/a 290n/an/an/an/a7.425



University of Marburg



Assay Description
Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...


J Med Chem 47: 550-7 (2004)


Article DOI: 10.1021/jm030912m
BindingDB Entry DOI: 10.7270/Q2W957DZ
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM13065
PNG
(5-(4-chlorophenyl)-1-(4-methoxyphenyl)-3-(trifluor...)
Show SMILES COc1ccc(cc1)-n1nc(cc1-c1ccc(Cl)cc1)C(F)(F)F
Show InChI InChI=1S/C17H12ClF3N2O/c1-24-14-8-6-13(7-9-14)23-15(10-16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3
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n/an/a>1.00E+5n/an/an/an/a7.425



University of Marburg



Assay Description
Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...


J Med Chem 47: 550-7 (2004)


Article DOI: 10.1021/jm030912m
BindingDB Entry DOI: 10.7270/Q2W957DZ
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM13066
PNG
(2-{2-[(2,6-dichlorophenyl)amino]phenyl}acetic acid...)
Show SMILES OC(=O)Cc1ccccc1Nc1c(Cl)cccc1Cl
Show InChI InChI=1S/C14H11Cl2NO2/c15-10-5-3-6-11(16)14(10)17-12-7-2-1-4-9(12)8-13(18)19/h1-7,17H,8H2,(H,18,19)
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n/an/a>1.00E+5n/an/an/an/a7.425



University of Marburg



Assay Description
Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...


J Med Chem 47: 550-7 (2004)


Article DOI: 10.1021/jm030912m
BindingDB Entry DOI: 10.7270/Q2W957DZ
More data for this
Ligand-Target Pair
Carbonic Anhydrase IV


(Bos taurus (bovine))
BDBM13064
PNG
(4-(4-fluorophenyl)-1-(4-methanesulfonylphenyl)-3-(...)
Show SMILES CS(=O)(=O)c1ccc(cc1)-n1cc(c(n1)C(F)(F)F)-c1ccc(F)cc1
Show InChI InChI=1S/C17H12F4N2O2S/c1-26(24,25)14-8-6-13(7-9-14)23-10-15(16(22-23)17(19,20)21)11-2-4-12(18)5-3-11/h2-10H,1H3
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n/an/a>1.00E+5n/an/an/an/a7.425



University of Marburg



Assay Description
Initial rates of 4-nitrophenyl acetate hydrolysis catalyzed by different CA isozymes were monitored spectrophotometrically at 400 nm. A molar absorpt...


J Med Chem 47: 550-7 (2004)


Article DOI: 10.1021/jm030912m
BindingDB Entry DOI: 10.7270/Q2W957DZ
More data for this
Ligand-Target Pair