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| Reaction Details | |||
|---|---|---|---|
 | Report a problem with these data | ||
| Target | Carbonic anhydrase 1 | ||
| Ligand | BDBM50428381 | ||
| Substrate/Competitor | n/a | ||
| Meas. Tech. | ChEMBL_942106 (CHEMBL2340804) | ||
| Ki | 500±n/a nM | ||
| Citation |  Carta, F; Vullo, D; Maresca, A; Scozzafava, A; Supuran, CT Mono-/dihydroxybenzoic acid esters and phenol pyridinium derivatives as inhibitors of the mammalian carbonic anhydrase isoforms I, II, VII, IX, XII and XIV. Bioorg Med Chem21:1564-9 (2013) [PubMed] Article | ||
| More Info.: | Get all data from this article, Assay Method | ||
| Carbonic anhydrase 1 | |||
| 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: |
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| BDBM50428381 | |||
| n/a | |||
| Name | BDBM50428381 | ||
| Synonyms: | CHEMBL2333961 | ||
| Type | Small organic molecule | ||
| Emp. Form. | C14H15ClNO | ||
| Mol. Mass. | 248.727 | ||
| SMILES | Cc1cc(C)[n+](c(C)c1)-c1cc(O)ccc1Cl |(71.56,-44.69,;72.9,-45.46,;74.23,-44.69,;75.56,-45.45,;76.89,-44.68,;75.57,-47,;74.23,-47.78,;74.23,-49.32,;72.9,-47.01,;76.9,-47.77,;78.22,-47,;79.56,-47.76,;80.89,-46.98,;79.56,-49.31,;78.23,-50.08,;76.9,-49.31,;75.56,-50.08,)| | ||
| Structure | 
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