| Reaction Details |
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 | Report a problem with these data |
| Target | Carbonic anhydrase 1 |
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| Ligand | BDBM50258733 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_499840 (CHEMBL972472) |
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| Ki | 7690±n/a nM |
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| Citation |  Gitto, R; Ferro, S; Agnello, S; De Luca, L; De Sarro, G; Russo, E; Vullo, D; Supuran, CT; Chimirri, A Synthesis and evaluation of pharmacological profile of 1-aryl-6,7-dimethoxy-3,4-dihydroisoquinoline-2(1H)-sulfonamides. Bioorg Med Chem17:3659-64 (2009) [PubMed] Article |
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| More Info.: | Get all data from this article, Assay Method |
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| Carbonic anhydrase 1 |
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| Name: | Carbonic anhydrase 1 |
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| Synonyms: | CA-I | CA1 | CAB | CAH1_HUMAN | Carbonate dehydratase I | Carbonic anhydrase | Carbonic anhydrase 1 (CA I) | Carbonic anhydrase 1 (CA-I) | Carbonic anhydrase 1 (Recombinant CA I) | Carbonic anhydrase 2 (CA II) | Carbonic anhydrase B | Carbonic anhydrase I | Carbonic anhydrase I (CA I) | Carbonic anhydrase I (CA-I) | Carbonic anhydrase I (CAI) | Carbonic anhydrase I (hCA I) | Carbonic anhydrase isoenzyme I (hCA I) | hCA |
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| Type: | Enzyme |
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| Mol. Mass.: | 28873.37 |
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| Organism: | Homo sapiens (Human) |
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| Description: | P00915 |
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| Residue: | 261 |
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| Sequence: | MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEI
INVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELH
VAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNF
DPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAV
PMQHNNRPTQPLKGRTVRASF
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| BDBM50258733 |
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| n/a |
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| Name | BDBM50258733 |
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| Synonyms: | 6,7-Dimethoxy-1-(3'-nitrophenyl)-3,4-dihydroisoquinoline-2(1H)-sulfonamide | CHEMBL468105 |
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| Type | Small organic molecule |
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| Emp. Form. | C17H19N3O6S |
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| Mol. Mass. | 393.414 |
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| SMILES | COc1cc2CCN(C(c3cccc(c3)[N+]([O-])=O)c2cc1OC)S(N)(=O)=O |
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| Structure | 
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