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PubMed code 22377674

Compile data set for download or QSAR
Found 80 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 9


(Homo sapiens (Human))
BDBM50366104
PNG
(CHEMBL1957180)
Show SMILES C=CCOc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C12H10O3/c1-2-7-14-11-8-12(13)15-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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210n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366096
PNG
(CHEMBL1957175)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-7-8-13-11(10-12)6-9-14(16)17-13/h6-10H,1-5H3
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280n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366097
PNG
(CHEMBL1957176)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-7-8-13-11(10-12)6-9-14(18)16-13/h6-10H,1-5H3
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310n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366101
PNG
(CHEMBL1955879)
Show SMILES Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-5,10H
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320n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366098
PNG
(CHEMBL1957177)
Show SMILES Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5,10H
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340n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366100
PNG
(CHEMBL1957179)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-8-6-11-7-9-14(18)16-13(11)10-12/h6-10H,1-5H3
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350n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366111
PNG
(CHEMBL1951641)
Show SMILES CC(=O)Nc1ccc2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C12H11NO3/c1-7-5-12(15)16-11-6-9(13-8(2)14)3-4-10(7)11/h3-6H,1-2H3,(H,13,14)
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390n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366109
PNG
(CHEMBL1957185)
Show SMILES Cc1ccc(cc1)S(=O)(=O)OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C18H16O6S/c1-13-2-7-16(8-3-13)25(20,21)23-11-10-22-15-6-4-14-5-9-18(19)24-17(14)12-15/h2-9,12H,10-11H2,1H3
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530n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366113
PNG
(CHEMBL1957188)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)OC(C)(C)C)ccc12
Show InChI InChI=1S/C15H17NO4/c1-9-7-13(17)19-12-8-10(5-6-11(9)12)16-14(18)20-15(2,3)4/h5-8H,1-4H3,(H,16,18)
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580n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366110
PNG
(CHEMBL1957186)
Show SMILES FCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H9FO3/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7H,5-6H2
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590n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366112
PNG
(CHEMBL1957187)
Show SMILES Cc1cc(C)cc(NC(=O)Nc2ccc3c(C)cc(=O)oc3c2)c1
Show InChI InChI=1S/C19H18N2O3/c1-11-6-12(2)8-15(7-11)21-19(23)20-14-4-5-16-13(3)9-18(22)24-17(16)10-14/h4-10H,1-3H3,(H2,20,21,23)
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610n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366108
PNG
(CHEMBL1957184)
Show SMILES OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H10O4/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7,12H,5-6H2
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630n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366112
PNG
(CHEMBL1957187)
Show SMILES Cc1cc(C)cc(NC(=O)Nc2ccc3c(C)cc(=O)oc3c2)c1
Show InChI InChI=1S/C19H18N2O3/c1-11-6-12(2)8-15(7-11)21-19(23)20-14-4-5-16-13(3)9-18(22)24-17(16)10-14/h4-10H,1-3H3,(H2,20,21,23)
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640n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366103
PNG
(CHEMBL432745)
Show SMILES C=CCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-5-3-9-4-6-12(13)15-11(9)8-10/h2-6,8H,1,7H2
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640n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366110
PNG
(CHEMBL1957186)
Show SMILES FCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H9FO3/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7H,5-6H2
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680n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366103
PNG
(CHEMBL432745)
Show SMILES C=CCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-5-3-9-4-6-12(13)15-11(9)8-10/h2-6,8H,1,7H2
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730n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366101
PNG
(CHEMBL1955879)
Show SMILES Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-5,10H
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780n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366096
PNG
(CHEMBL1957175)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-7-8-13-11(10-12)6-9-14(16)17-13/h6-10H,1-5H3
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800n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366102
PNG
(CHEMBL1957172)
Show SMILES C=CCOc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-4-5-11-9(8-10)3-6-12(13)15-11/h2-6,8H,1,7H2
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800n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366098
PNG
(CHEMBL1957177)
Show SMILES Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5,10H
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800n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366099
PNG
(CHEMBL1957178)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-8-6-11-7-9-14(16)17-13(11)10-12/h6-10H,1-5H3
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830n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366099
PNG
(CHEMBL1957178)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-8-6-11-7-9-14(16)17-13(11)10-12/h6-10H,1-5H3
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850n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366097
PNG
(CHEMBL1957176)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-7-8-13-11(10-12)6-9-14(18)16-13/h6-10H,1-5H3
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860n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366104
PNG
(CHEMBL1957180)
Show SMILES C=CCOc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C12H10O3/c1-2-7-14-11-8-12(13)15-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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880n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366109
PNG
(CHEMBL1957185)
Show SMILES Cc1ccc(cc1)S(=O)(=O)OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C18H16O6S/c1-13-2-7-16(8-3-13)25(20,21)23-11-10-22-15-6-4-14-5-9-18(19)24-17(14)12-15/h2-9,12H,10-11H2,1H3
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900n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366111
PNG
(CHEMBL1951641)
Show SMILES CC(=O)Nc1ccc2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C12H11NO3/c1-7-5-12(15)16-11-6-9(13-8(2)14)3-4-10(7)11/h3-6H,1-2H3,(H,13,14)
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910n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366108
PNG
(CHEMBL1957184)
Show SMILES OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H10O4/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7,12H,5-6H2
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920n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366102
PNG
(CHEMBL1957172)
Show SMILES C=CCOc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-4-5-11-9(8-10)3-6-12(13)15-11/h2-6,8H,1,7H2
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930n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366100
PNG
(CHEMBL1957179)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-8-6-11-7-9-14(18)16-13(11)10-12/h6-10H,1-5H3
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960n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366113
PNG
(CHEMBL1957188)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)OC(C)(C)C)ccc12
Show InChI InChI=1S/C15H17NO4/c1-9-7-13(17)19-12-8-10(5-6-11(9)12)16-14(18)20-15(2,3)4/h5-8H,1-4H3,(H,16,18)
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970n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366105
PNG
(CHEMBL1957181)
Show SMILES C=CCOc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-4-5-11-9(8-10)3-6-12(15)14-11/h2-6,8H,1,7H2
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1.25E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366107
PNG
(CHEMBL1957183)
Show SMILES C=CCOc1cc(=S)oc2ccccc12
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-11-8-12(15)14-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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1.27E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM50366106
PNG
(CHEMBL1957182)
Show SMILES C=CCOc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-5-3-9-4-6-12(15)14-11(9)8-10/h2-6,8H,1,7H2
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2.83E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366107
PNG
(CHEMBL1957183)
Show SMILES C=CCOc1cc(=S)oc2ccccc12
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-11-8-12(15)14-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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3.04E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM12342
PNG
(2H-chromen-2-one | CHEMBL6466 | Coumarin)
Show SMILES O=c1ccc2ccccc2o1
Show InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
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3.10E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366106
PNG
(CHEMBL1957182)
Show SMILES C=CCOc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-5-3-9-4-6-12(15)14-11(9)8-10/h2-6,8H,1,7H2
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3.23E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM50366105
PNG
(CHEMBL1957181)
Show SMILES C=CCOc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-4-5-11-9(8-10)3-6-12(15)14-11/h2-6,8H,1,7H2
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3.26E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM71742
PNG
(7-amino-4-methyl-1-benzopyran-2-one | 7-amino-4-me...)
Show SMILES Cc1cc(=O)oc2cc(N)ccc12
Show InChI InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3
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5.56E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366098
PNG
(CHEMBL1957177)
Show SMILES Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5,10H
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7.17E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366097
PNG
(CHEMBL1957176)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-7-8-13-11(10-12)6-9-14(18)16-13/h6-10H,1-5H3
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7.57E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366106
PNG
(CHEMBL1957182)
Show SMILES C=CCOc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-5-3-9-4-6-12(15)14-11(9)8-10/h2-6,8H,1,7H2
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7.60E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM71742
PNG
(7-amino-4-methyl-1-benzopyran-2-one | 7-amino-4-me...)
Show SMILES Cc1cc(=O)oc2cc(N)ccc12
Show InChI InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3
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7.64E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366101
PNG
(CHEMBL1955879)
Show SMILES Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-5,10H
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8.02E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366100
PNG
(CHEMBL1957179)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-8-6-11-7-9-14(18)16-13(11)10-12/h6-10H,1-5H3
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8.18E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366099
PNG
(CHEMBL1957178)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-8-6-11-7-9-14(16)17-13(11)10-12/h6-10H,1-5H3
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8.32E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366105
PNG
(CHEMBL1957181)
Show SMILES C=CCOc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-4-5-11-9(8-10)3-6-12(15)14-11/h2-6,8H,1,7H2
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8.51E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366096
PNG
(CHEMBL1957175)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-7-8-13-11(10-12)6-9-14(16)17-13/h6-10H,1-5H3
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8.78E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM71742
PNG
(7-amino-4-methyl-1-benzopyran-2-one | 7-amino-4-me...)
Show SMILES Cc1cc(=O)oc2cc(N)ccc12
Show InChI InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3
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9.13E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM12342
PNG
(2H-chromen-2-one | CHEMBL6466 | Coumarin)
Show SMILES O=c1ccc2ccccc2o1
Show InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
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9.20E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366107
PNG
(CHEMBL1957183)
Show SMILES C=CCOc1cc(=S)oc2ccccc12
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-11-8-12(15)14-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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9.24E+3n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366108
PNG
(CHEMBL1957184)
Show SMILES OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H10O4/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7,12H,5-6H2
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PubMed
2.44E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366102
PNG
(CHEMBL1957172)
Show SMILES C=CCOc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-4-5-11-9(8-10)3-6-12(13)15-11/h2-6,8H,1,7H2
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3.03E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366112
PNG
(CHEMBL1957187)
Show SMILES Cc1cc(C)cc(NC(=O)Nc2ccc3c(C)cc(=O)oc3c2)c1
Show InChI InChI=1S/C19H18N2O3/c1-11-6-12(2)8-15(7-11)21-19(23)20-14-4-5-16-13(3)9-18(22)24-17(16)10-14/h4-10H,1-3H3,(H2,20,21,23)
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3.88E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366110
PNG
(CHEMBL1957186)
Show SMILES FCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H9FO3/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7H,5-6H2
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4.29E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366104
PNG
(CHEMBL1957180)
Show SMILES C=CCOc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C12H10O3/c1-2-7-14-11-8-12(13)15-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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4.32E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366111
PNG
(CHEMBL1951641)
Show SMILES CC(=O)Nc1ccc2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C12H11NO3/c1-7-5-12(15)16-11-6-9(13-8(2)14)3-4-10(7)11/h3-6H,1-2H3,(H,13,14)
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4.77E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366109
PNG
(CHEMBL1957185)
Show SMILES Cc1ccc(cc1)S(=O)(=O)OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C18H16O6S/c1-13-2-7-16(8-3-13)25(20,21)23-11-10-22-15-6-4-14-5-9-18(19)24-17(14)12-15/h2-9,12H,10-11H2,1H3
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6.63E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366103
PNG
(CHEMBL432745)
Show SMILES C=CCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-5-3-9-4-6-12(13)15-11(9)8-10/h2-6,8H,1,7H2
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7.29E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 1


(Homo sapiens (Human))
BDBM50366113
PNG
(CHEMBL1957188)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)OC(C)(C)C)ccc12
Show InChI InChI=1S/C15H17NO4/c1-9-7-13(17)19-12-8-10(5-6-11(9)12)16-14(18)20-15(2,3)4/h5-8H,1-4H3,(H,16,18)
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9.17E+4n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 1 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM71742
PNG
(7-amino-4-methyl-1-benzopyran-2-one | 7-amino-4-me...)
Show SMILES Cc1cc(=O)oc2cc(N)ccc12
Show InChI InChI=1S/C10H9NO2/c1-6-4-10(12)13-9-5-7(11)2-3-8(6)9/h2-5H,11H2,1H3
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 12


(Homo sapiens (Human))
BDBM12342
PNG
(2H-chromen-2-one | CHEMBL6466 | Coumarin)
Show SMILES O=c1ccc2ccccc2o1
Show InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 12 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366113
PNG
(CHEMBL1957188)
Show SMILES Cc1cc(=O)oc2cc(NC(=O)OC(C)(C)C)ccc12
Show InChI InChI=1S/C15H17NO4/c1-9-7-13(17)19-12-8-10(5-6-11(9)12)16-14(18)20-15(2,3)4/h5-8H,1-4H3,(H,16,18)
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366101
PNG
(CHEMBL1955879)
Show SMILES Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-3-1-6-2-4-9(12)11-8(6)5-7/h1-5,10H
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366096
PNG
(CHEMBL1957175)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-7-8-13-11(10-12)6-9-14(16)17-13/h6-10H,1-5H3
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366100
PNG
(CHEMBL1957179)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-8-6-11-7-9-14(18)16-13(11)10-12/h6-10H,1-5H3
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366098
PNG
(CHEMBL1957177)
Show SMILES Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C9H6O2S/c10-7-2-3-8-6(5-7)1-4-9(12)11-8/h1-5,10H
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366112
PNG
(CHEMBL1957187)
Show SMILES Cc1cc(C)cc(NC(=O)Nc2ccc3c(C)cc(=O)oc3c2)c1
Show InChI InChI=1S/C19H18N2O3/c1-11-6-12(2)8-15(7-11)21-19(23)20-14-4-5-16-13(3)9-18(22)24-17(16)10-14/h4-10H,1-3H3,(H2,20,21,23)
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366107
PNG
(CHEMBL1957183)
Show SMILES C=CCOc1cc(=S)oc2ccccc12
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-11-8-12(15)14-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366103
PNG
(CHEMBL432745)
Show SMILES C=CCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-5-3-9-4-6-12(13)15-11(9)8-10/h2-6,8H,1,7H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366102
PNG
(CHEMBL1957172)
Show SMILES C=CCOc1ccc2oc(=O)ccc2c1
Show InChI InChI=1S/C12H10O3/c1-2-7-14-10-4-5-11-9(8-10)3-6-12(13)15-11/h2-6,8H,1,7H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366109
PNG
(CHEMBL1957185)
Show SMILES Cc1ccc(cc1)S(=O)(=O)OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C18H16O6S/c1-13-2-7-16(8-3-13)25(20,21)23-11-10-22-15-6-4-14-5-9-18(19)24-17(14)12-15/h2-9,12H,10-11H2,1H3
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Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366105
PNG
(CHEMBL1957181)
Show SMILES C=CCOc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-4-5-11-9(8-10)3-6-12(15)14-11/h2-6,8H,1,7H2
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Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366097
PNG
(CHEMBL1957176)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2oc(=S)ccc2c1
Show InChI InChI=1S/C15H20O2SSi/c1-15(2,3)19(4,5)17-12-7-8-13-11(10-12)6-9-14(18)16-13/h6-10H,1-5H3
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Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366106
PNG
(CHEMBL1957182)
Show SMILES C=CCOc1ccc2ccc(=S)oc2c1
Show InChI InChI=1S/C12H10O2S/c1-2-7-13-10-5-3-9-4-6-12(15)14-11(9)8-10/h2-6,8H,1,7H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366104
PNG
(CHEMBL1957180)
Show SMILES C=CCOc1cc(=O)oc2ccccc12
Show InChI InChI=1S/C12H10O3/c1-2-7-14-11-8-12(13)15-10-6-4-3-5-9(10)11/h2-6,8H,1,7H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366099
PNG
(CHEMBL1957178)
Show SMILES CC(C)(C)[Si](C)(C)Oc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C15H20O3Si/c1-15(2,3)19(4,5)18-12-8-6-11-7-9-14(16)17-13(11)10-12/h6-10H,1-5H3
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Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366111
PNG
(CHEMBL1951641)
Show SMILES CC(=O)Nc1ccc2c(C)cc(=O)oc2c1
Show InChI InChI=1S/C12H11NO3/c1-7-5-12(15)16-11-6-9(13-8(2)14)3-4-10(7)11/h3-6H,1-2H3,(H,13,14)
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366110
PNG
(CHEMBL1957186)
Show SMILES FCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H9FO3/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7H,5-6H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 9


(Homo sapiens (Human))
BDBM12342
PNG
(2H-chromen-2-one | CHEMBL6466 | Coumarin)
Show SMILES O=c1ccc2ccccc2o1
Show InChI InChI=1S/C9H6O2/c10-9-6-5-7-3-1-2-4-8(7)11-9/h1-6H
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 9 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
Carbonic anhydrase 2


(Homo sapiens (Human))
BDBM50366108
PNG
(CHEMBL1957184)
Show SMILES OCCOc1ccc2ccc(=O)oc2c1
Show InChI InChI=1S/C11H10O4/c12-5-6-14-9-3-1-8-2-4-11(13)15-10(8)7-9/h1-4,7,12H,5-6H2
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>2.00E+5n/an/an/an/an/an/an/an/a



Universit£ degli Studi di Firenze

Curated by ChEMBL


Assay Description
Inhibition of human carbonic anhydrase 2 after 6 hrs by stop-flow CO2 hydration assay


Bioorg Med Chem 20: 2266-73 (2012)


Article DOI: 10.1016/j.bmc.2012.02.014
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%