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Compile Data Set for Download or QSAR

Found 16 hits from Balikesir University Science & Art Faculty   
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 2


(Homo sapiens (human))
BDBM86065
PNG
(DCP)
Show SMILES Oc1cc2cc(-c3ccccc3)c(=O)oc2cc1O
Show InChI InChI=1S/C15H10O4/c16-12-7-10-6-11(9-4-2-1-3-5-9)15(18)19-14(10)8-13(12)17/h1-8,16-17H
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PubMed
n/an/a 6.17E+4n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86065
PNG
(DCP)
Show SMILES Oc1cc2cc(-c3ccccc3)c(=O)oc2cc1O
Show InChI InChI=1S/C15H10O4/c16-12-7-10-6-11(9-4-2-1-3-5-9)15(18)19-14(10)8-13(12)17/h1-8,16-17H
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PubMed
n/an/a 1.24E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86068
PNG
(PPC)
Show SMILES Cc1ccc(cc1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-2-4-10(5-3-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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n/an/a 1.27E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86066
PNG
(OPC)
Show SMILES Cc1ccccc1-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-4-2-3-5-11(9)12-6-10-7-13(17)14(18)8-15(10)20-16(12)19/h2-8,17-18H,1H3
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n/an/a 1.53E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86065
PNG
(DCP)
Show SMILES Oc1cc2cc(-c3ccccc3)c(=O)oc2cc1O
Show InChI InChI=1S/C15H10O4/c16-12-7-10-6-11(9-4-2-1-3-5-9)15(18)19-14(10)8-13(12)17/h1-8,16-17H
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PubMed
n/an/a 1.60E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86066
PNG
(OPC)
Show SMILES Cc1ccccc1-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-4-2-3-5-11(9)12-6-10-7-13(17)14(18)8-15(10)20-16(12)19/h2-8,17-18H,1H3
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n/an/a 1.63E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86067
PNG
(MPC)
Show SMILES Cc1cccc(c1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-3-2-4-10(5-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 2.01E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86066
PNG
(OPC)
Show SMILES Cc1ccccc1-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-4-2-3-5-11(9)12-6-10-7-13(17)14(18)8-15(10)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 2.06E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86065
PNG
(DCP)
Show SMILES Oc1cc2cc(-c3ccccc3)c(=O)oc2cc1O
Show InChI InChI=1S/C15H10O4/c16-12-7-10-6-11(9-4-2-1-3-5-9)15(18)19-14(10)8-13(12)17/h1-8,16-17H
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PubMed
n/an/a 2.46E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86068
PNG
(PPC)
Show SMILES Cc1ccc(cc1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-2-4-10(5-3-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 2.56E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86068
PNG
(PPC)
Show SMILES Cc1ccc(cc1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-2-4-10(5-3-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 2.72E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86067
PNG
(MPC)
Show SMILES Cc1cccc(c1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-3-2-4-10(5-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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n/an/a 3.20E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86066
PNG
(OPC)
Show SMILES Cc1ccccc1-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-4-2-3-5-11(9)12-6-10-7-13(17)14(18)8-15(10)20-16(12)19/h2-8,17-18H,1H3
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n/an/a 3.63E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86067
PNG
(MPC)
Show SMILES Cc1cccc(c1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-3-2-4-10(5-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 5.04E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (human))
BDBM86068
PNG
(PPC)
Show SMILES Cc1ccc(cc1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-2-4-10(5-3-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 5.61E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair
Carbonic anhydrase


(Homo sapiens (human))
BDBM86067
PNG
(MPC)
Show SMILES Cc1cccc(c1)-c1cc2cc(O)c(O)cc2oc1=O
Show InChI InChI=1S/C16H12O4/c1-9-3-2-4-10(5-9)12-6-11-7-13(17)14(18)8-15(11)20-16(12)19/h2-8,17-18H,1H3
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PubMed
n/an/a 8.37E+5n/an/an/an/a10.0n/a



Balikesir University Science & Art Faculty



Assay Description
Carbonic anhydrase enzyme activity was assayed both with respect to its hydratase activity (i.e. hydration of CO2) and to its esterase activity (i.e....


J Enzyme Inhib Med Chem 23: 32-6 (2008)


Article DOI: 10.1080/14756360701404100
BindingDB Entry DOI: 10.7270/Q2T1526T
More data for this
Ligand-Target Pair