| Reaction Details |
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 | Report a problem with these data |
| Target | Carbonic anhydrase 1 |
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| Ligand | BDBM74795 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | Esterase Activity Assay |
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| pH | 7.4±n/a |
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| Ki | 3.1e+4± 7.5e+3 nM |
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| IC50 | 3.4e+4±n/a nM |
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| Comments | extracted |
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| Citation |  Ayvaz, S; Çankaya, M; Atasever, A; Altuntas, A 2-Amino-3-cyanopyridine derivatives as carbonic anhydrase inhibitors. J Enzyme Inhib Med Chem28:305-10 (2013) [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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| BDBM74795 |
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| n/a |
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| Name | BDBM74795 |
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| Synonyms: | 2-Amino-4-(5-methyl-thiophen-2-yl)-5,6,7,8-tetrahydro-quinoline-3-carbonitrile | 2-amino-4-(5-methyl-2-thienyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile | 2-amino-4-(5-methyl-2-thiophenyl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile | 2-amino-4-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile | 2-azanyl-4-(5-methylthiophen-2-yl)-5,6,7,8-tetrahydroquinoline-3-carbonitrile | CA inhibitor, 5b | MLS000563329 | SMR000175799 | cid_794068 |
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| Type | Small organic molecule |
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| Emp. Form. | C15H15N3S |
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| Mol. Mass. | 269.365 |
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| SMILES | Cc1ccc(s1)-c1c2CCCCc2nc(N)c1C#N |
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| Structure | 
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