Reaction Details |
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Target | Carbonic anhydrase |
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Ligand | BDBM13063 |
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Substrate/Competitor | n/a |
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Meas. Tech. | ChEMBL_1543853 (CHEMBL3749743) |
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Ki | 5.3±n/a nM |
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Citation | Vullo, D; Bhatt, A; Mahon, BP; McKenna, R; Supuran, CT Sulfonamide inhibition studies of thea-carbonic anhydrase from the gammaproteobacterium Thiomicrospira crunogena XCL-2, TcruCA. Bioorg Med Chem Lett26:401-5 (2016) [PubMed] Article |
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More Info.: | Get all data from this article, Assay Method |
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Carbonic anhydrase |
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Name: | Carbonic anhydrase |
Synonyms: | 4.2.1.1 | Carbonate dehydratase |
Type: | PROTEIN |
Mol. Mass.: | 28438.71 |
Organism: | Sulfurihydrogenibium sp. (strain YO3AOP1) |
Description: | ChEMBL_116696 |
Residue: | 246 |
Sequence: | MRKILISAVLVLSSISISFAEHEWSYEGEKGPEHWAQLKPEFFWCKLKNQSPINIDKKYK
VKANLPKLNLYYKTAKESEVVNNGHTIQINIKEDNTLNYLGEKYQLKQFHFHTPSEHTIE
KKSYPLEIHFVHKTEDGKILVVGVMAKLGKTNKELDKILNVAPAEEGEKILDKNLNLNNL
IPKDKRYMTYSGSLTTPPCTEGVRWIVLKKPISISKQQLEKLKSVMVNPNNRPVQEINSR
WIIEGF
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BDBM13063 |
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n/a |
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Name | BDBM13063 |
Synonyms: | 4-(5-methyl-3-phenyl-1,2-oxazol-4-yl)benzene-1-sulfonamide | Bextra | CHEMBL865 | VLX | Valdecoxib | cid_119607 |
Type | Small organic molecule |
Emp. Form. | C16H14N2O3S |
Mol. Mass. | 314.359 |
SMILES | Cc1onc(c1-c1ccc(cc1)S(N)(=O)=O)-c1ccccc1 |
Structure |
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