Found 26 hits for monomerid = 12414 Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Carbonic anhydrase
(Bos taurus) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
KEGG
UniProtKB/SwissProt
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| Article PubMed
| 178 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Tokushima Graduate School
Curated by ChEMBL
| Assay Description Binding affinity to bovine carbonic anhydrase 2 |
Bioorg Med Chem Lett 21: 141-4 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.050 BindingDB Entry DOI: 10.7270/Q2K938T6 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase
(Bos taurus) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
KEGG
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| Article PubMed
| 178 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
The University of Tokushima Graduate School
Curated by ChEMBL
| Assay Description Binding affinity to bovine carbonic anhydrase 2 |
Bioorg Med Chem Lett 21: 141-4 (2010)
Article DOI: 10.1016/j.bmcl.2010.11.050 BindingDB Entry DOI: 10.7270/Q2K938T6 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB Article PubMed
| 305 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Union Life Sciences Ltd.
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 2 preincubated for 15 mins measured for 10 to 100 sec by stopped-flow method |
J Med Chem 55: 3513-20 (2012)
Article DOI: 10.1021/jm300203r BindingDB Entry DOI: 10.7270/Q2RX9D4X |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB Article PubMed
| 430 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Artvin£oruh University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 2 esterase activity using 4-nitrophenylacetate as substrate |
Bioorg Med Chem Lett 22: 1352-7 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.069 BindingDB Entry DOI: 10.7270/Q2WH2QF4 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| 1.10E+3 | -8.12 | n/a | n/a | n/a | n/a | n/a | 7.4 | 25 |
Ondokuz Mayis University
| Assay Description Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ... |
J Enzyme Inhib Med Chem 27: 744-7 (2012)
Article DOI: 10.3109/14756366.2011.614607 BindingDB Entry DOI: 10.7270/Q2H70DQ2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| 1.10E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Gebze Technical University
Curated by ChEMBL
| Assay Description Inhibition of cytosolic carbonic anhydrase 2 esterase activity isolated from human serum using 4-nitrophenylacetate as substrate measured over 3 mins... |
Bioorg Med Chem 23: 7353-8 (2015)
BindingDB Entry DOI: 10.7270/Q2ZS2ZB2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 4
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| Article PubMed
| 1.12E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Artvin£oruh University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 4 esterase activity using 4-nitrophenylacetate as substrate |
Bioorg Med Chem Lett 22: 1352-7 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.069 BindingDB Entry DOI: 10.7270/Q2WH2QF4 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 6 (CA-VI)
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB
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| 2.97E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Artvin£oruh University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 6 esterase activity using 4-nitrophenylacetate as substrate |
Bioorg Med Chem Lett 22: 1352-7 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.069 BindingDB Entry DOI: 10.7270/Q2WH2QF4 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| 3.30E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Kyoto University
Curated by ChEMBL
| Assay Description Inhibition of carbonic anhydrase 1 in human RBC cells by SDS-PAGE/fluorescence gel imaging |
Nat Chem Biol 5: 341-3 (2009)
Article DOI: 10.1038/nchembio.157 BindingDB Entry DOI: 10.7270/Q2W37WHV |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 6 (CA-VI)
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB
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| 4.11E+3 | -7.34 | n/a | n/a | n/a | n/a | n/a | 7.4 | 25 |
Ondokuz Mayis University
| Assay Description Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ... |
J Enzyme Inhib Med Chem 27: 744-7 (2012)
Article DOI: 10.3109/14756366.2011.614607 BindingDB Entry DOI: 10.7270/Q2H70DQ2 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| 5.87E+3 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Agri Ibrahim Cecen University
Curated by ChEMBL
| Assay Description Inhibition of human esterase activity of carbonic anhydrase 2 using 4-nitrophenylacetate as substrate after 3 mins by spectrophotometric analysis |
Bioorg Med Chem 21: 1522-5 (2013)
Article DOI: 10.1016/j.bmc.2012.08.018 BindingDB Entry DOI: 10.7270/Q2NG4S0C |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| Article PubMed
| 1.24E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Artvin£oruh University
Curated by ChEMBL
| Assay Description Inhibition of human carbonic anhydrase 1 esterase activity using 4-nitrophenylacetate as substrate |
Bioorg Med Chem Lett 22: 1352-7 (2012)
Article DOI: 10.1016/j.bmcl.2011.12.069 BindingDB Entry DOI: 10.7270/Q2WH2QF4 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| 4.00E+4 | n/a | n/a | n/a | n/a | n/a | n/a | n/a | n/a |
Gebze Technical University
Curated by ChEMBL
| Assay Description Inhibition of cytosolic carbonic anhydrase 1 esterase activity isolated from human serum using 4-nitrophenylacetate as substrate measured over 3 mins... |
Bioorg Med Chem 23: 7353-8 (2015)
BindingDB Entry DOI: 10.7270/Q2ZS2ZB2 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| Article PubMed
| 4.00E+4 | -6.00 | n/a | n/a | n/a | n/a | n/a | 7.4 | 25 |
Ondokuz Mayis University
| Assay Description Carbonic anhydrase activity was assayed by following the change in absorbance at 348 nm of 4-nitrophenylacetate (NPA) to 4-nitrophenylate ion over a ... |
J Enzyme Inhib Med Chem 27: 744-7 (2012)
Article DOI: 10.3109/14756366.2011.614607 BindingDB Entry DOI: 10.7270/Q2H70DQ2 |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 13 (CA XIII)
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB
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| Article PubMed
| n/a | n/a | n/a | 1.00E+4 | n/a | n/a | n/a | 7.0 | n/a |
Vilnius University Institute of Biotechnology
Curated by ChEMBL
| Assay Description Binding affinity to human recombinant CA13 at 37 degC and pH 7.0 by thermal shift assay |
Bioorg Med Chem 21: 2093-106 (2013)
Article DOI: 10.1016/j.bmc.2013.01.008 BindingDB Entry DOI: 10.7270/Q2PV6MQK |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 12
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| Article PubMed
| n/a | n/a | n/a | 1.25E+4 | n/a | n/a | n/a | 7.0 | n/a |
Vilnius University Institute of Biotechnology
Curated by ChEMBL
| Assay Description Binding affinity to human recombinant CA12 at 37 degC and pH 7.0 by thermal shift assay |
Bioorg Med Chem 21: 2093-106 (2013)
Article DOI: 10.1016/j.bmc.2013.01.008 BindingDB Entry DOI: 10.7270/Q2PV6MQK |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 7
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| Article PubMed
| n/a | n/a | n/a | 6.67E+3 | n/a | n/a | n/a | 7.0 | n/a |
Vilnius University Institute of Biotechnology
Curated by ChEMBL
| Assay Description Binding affinity to human recombinant CA7 at 37 degC and pH 7.0 by thermal shift assay |
Bioorg Med Chem 21: 2093-106 (2013)
Article DOI: 10.1016/j.bmc.2013.01.008 BindingDB Entry DOI: 10.7270/Q2PV6MQK |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB Article PubMed
| n/a | n/a | n/a | 1.79E+3 | n/a | n/a | n/a | 7.0 | n/a |
Vilnius University Institute of Biotechnology
Curated by ChEMBL
| Assay Description Binding affinity to human recombinant CA2 at 37 degC and pH 7.0 by thermal shift assay |
Bioorg Med Chem 21: 2093-106 (2013)
Article DOI: 10.1016/j.bmc.2013.01.008 BindingDB Entry DOI: 10.7270/Q2PV6MQK |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| Article PubMed
| n/a | n/a | n/a | 7.14E+3 | n/a | n/a | n/a | 7.0 | n/a |
Vilnius University Institute of Biotechnology
Curated by ChEMBL
| Assay Description Binding affinity to human recombinant CA1 at 37 degC and pH 7.0 by thermal shift assay |
Bioorg Med Chem 21: 2093-106 (2013)
Article DOI: 10.1016/j.bmc.2013.01.008 BindingDB Entry DOI: 10.7270/Q2PV6MQK |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 1
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| Article PubMed
| n/a | n/a | n/a | 4.03E+3 | n/a | n/a | n/a | 7.0 | 25 |
University of Pennsylvania
| Assay Description The dissociation constant of the hCA and inhibitor complex was determined by competitive displacement of a fixed concentration of dansylamide by incr... |
J Am Chem Soc 128: 3011-8 (2006)
Article DOI: 10.1021/ja057257n BindingDB Entry DOI: 10.7270/Q2RR1WGF |
More data for this Ligand-Target Pair | |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB Article PubMed
| n/a | n/a | n/a | 660 | n/a | n/a | n/a | 7.0 | 25 |
University of Pennsylvania
| Assay Description The dissociation constant of the hCA and inhibitor complex was determined by competitive displacement of a fixed concentration of dansylamide by incr... |
J Am Chem Soc 128: 3011-8 (2006)
Article DOI: 10.1021/ja057257n BindingDB Entry DOI: 10.7270/Q2RR1WGF |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase I
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB
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| PDB PubMed
| n/a | n/a | 2.00E+3 | n/a | n/a | n/a | n/a | n/a | n/a |
Merck Research Laboratories
Curated by ChEMBL
| Assay Description In vitro inhibition of crude dog red blood cell carbonic anhydrase |
J Med Chem 36: 2134-41 (1993)
BindingDB Entry DOI: 10.7270/Q2GX49N1 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
LDL-associated phospholipase A2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
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| PDB PubMed
| n/a | n/a | >1.00E+6 | n/a | n/a | n/a | n/a | n/a | n/a |
Astex Pharmaceuticals
Curated by ChEMBL
| Assay Description Inhibition of human recombinant Lp-PLA2 using PED6 as substrate preincubated for 30 mins followed by substrate addition measured for 20 mins by fluor... |
J Med Chem 59: 5356-67 (2016)
BindingDB Entry DOI: 10.7270/Q2Z60R0G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB PubMed
| n/a | n/a | n/a | 1.15E+6 | n/a | n/a | n/a | n/a | n/a |
Istituto Italiano di Tecnologia
Curated by ChEMBL
| Assay Description Binding affinity to GST-fused human carbonic anhydrase-2 expressed in Escherichia coli BL21 codon plus cells assessed as dissociation constant by SPR... |
J Med Chem 59: 4245-56 (2016)
BindingDB Entry DOI: 10.7270/Q2PV6NB2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
Carbonic anhydrase 2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
Reactome pathway KEGG
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| MMDB PDB PubMed
| n/a | n/a | n/a | 1.14E+6 | n/a | n/a | n/a | n/a | n/a |
Istituto Italiano di Tecnologia
Curated by ChEMBL
| Assay Description Binding affinity to GST-fused human carbonic anhydrase-2 expressed in Escherichia coli BL21 codon plus cells assessed as steady state dissociation co... |
J Med Chem 59: 4245-56 (2016)
BindingDB Entry DOI: 10.7270/Q2PV6NB2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |
LDL-associated phospholipase A2
(Homo sapiens (Human)) | BDBM12414
(CHEMBL27601 | benzenesulfonamide | hCA inhibitor, ...)Show InChI InChI=1S/C6H7NO2S/c7-10(8,9)6-4-2-1-3-5-6/h1-5H,(H2,7,8,9) | PDB MMDB
NCI pathway Reactome pathway KEGG
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MMDB PC cid PC sid PDB UniChem
Patents
Similars
| PDB PubMed
| n/a | n/a | n/a | 3.40E+6 | n/a | n/a | n/a | n/a | n/a |
Astex Pharmaceuticals
Curated by ChEMBL
| Assay Description Binding affinity to N-terminal His6-tagged Lp-PLA2 (47 to 429 residues) (unknown origin) expressed in sf21 insect cells by ITC assay |
J Med Chem 59: 5356-67 (2016)
BindingDB Entry DOI: 10.7270/Q2Z60R0G |
More data for this Ligand-Target Pair | 3D Structure (crystal) |