Reaction Details |
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Target | Carbonic anhydrase 1 |
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Ligand | BDBM178058 |
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Substrate/Competitor | n/a |
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Meas. Tech. | CA I and II Esterase Assay |
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Ki | 454.91±98.23 nM |
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IC50 | 513.95±0.0 nM |
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Citation | Artunç, T; Çetinkaya, Y; Göçer, H; Gülçin, Ä°; Menzek, A; Sahin, E; Supuran, CT Synthesis of 4-[2-(3,4-dimethoxybenzyl)cyclopentyl]-1,2-dimethoxybenzene Derivatives and Evaluations of Their Carbonic Anhydrase Isoenzymes Inhibitory Effects. Chem Biol Drug Des87:594-607 (2016) [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 |
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 |
Type: | Enzyme |
Mol. Mass.: | 28873.37 |
Organism: | Homo sapiens (Human) |
Description: | P00915 |
Residue: | 261 |
Sequence: | MASPDWGYDDKNGPEQWSKLYPIANGNNQSPVDIKTSETKHDTSLKPISVSYNPATAKEI
INVGHSFHVNFEDNDNRSVLKGGPFSDSYRLFQFHFHWGSTNEHGSEHTVDGVKYSAELH
VAHWNSAKYSSLAEAASKADGLAVIGVLMKVGEANPKLQKVLDALQAIKTKGKRAPFTNF
DPSTLLPSSLDFWTYPGSLTHPPLYESVTWIICKESISVSSEQLAQFRSLLSNVEGDNAV
PMQHNNRPTQPLKGRTVRASF
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BDBM178058 |
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n/a |
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Name | BDBM178058 |
Synonyms: | (3,4-dimethoxyphenyl)[2-(3,4-dimethoxyphenyl)cyclopentyl]methanol (22) |
Type | Small organic molecule |
Emp. Form. | C22H28O5 |
Mol. Mass. | 372.4547 |
SMILES | COc1ccc(cc1OC)C(O)C1CCCC1c1ccc(OC)c(OC)c1 |
Structure |
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