Found 11 hits Enz. Inhib. hit(s) with Target = 'Carbonic anhydrase 2' and Ligand = 'BDBM12414' Target/Host (Institution) | Ligand | Target/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 | pH | Temp °C |
Carbonic anhydrase 2
(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
(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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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
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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
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UniProtKB/SwissProt
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Patents
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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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| MMDB PDB Article PubMed
| 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)
Article DOI: 10.1016/j.bmc.2015.10.009 BindingDB Entry DOI: 10.7270/Q2ZS2ZB2 |
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
UniProtKB/SwissProt
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| MMDB PDB Article PubMed
| 1.10E+3 | -34.0 | 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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| MMDB PDB Article PubMed
| 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 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
UniProtKB/SwissProt
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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| MMDB PDB Article 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)
Article DOI: 10.1021/acs.jmedchem.5b01643 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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
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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 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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
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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 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
UniProtKB/SwissProt
B.MOAD DrugBank antibodypedia GoogleScholar AffyNet
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CHEMBL MCE MMDB PC cid PC sid PDB UniChem
Patents
Similars
| MMDB PDB Article 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)
Article DOI: 10.1021/acs.jmedchem.5b01643 BindingDB Entry DOI: 10.7270/Q2PV6NB2 |
More data for this Ligand-Target Pair | 3D Structure (crystal) |