| Reaction Details |
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 | Report a problem with these data |
| Target | Carbonic anhydrase |
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| Ligand | BDBM50216277 |
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| Substrate/Competitor | n/a |
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| Meas. Tech. | ChEMBL_736724 (CHEMBL1695105) |
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| Ki | 730±n/a nM |
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| Citation |  Davis, RA; Hofmann, A; Osman, A; Hall, RA; Mühlschlegel, FA; Vullo, D; Innocenti, A; Supuran, CT; Poulsen, SA Natural product-based phenols as novel probes for mycobacterial and fungal carbonic anhydrases. J Med Chem54:1682-92 (2011) [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 |
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| Synonyms: | CAN_CANAL | NCE103 | beta-Carbonic Anhydrase |
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| Type: | Enzyme |
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| Mol. Mass.: | 31587.59 |
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| Organism: | Candida albicans (Yeast) |
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| Description: | n/a |
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| Residue: | 281 |
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| Sequence: | MGRENILKYQLEHDHESDLVTEKDQSLLLDNNNNLNGMNNTIKTHPVRVSSGNHNNFPFT
LSSESTLQDFLNNNKFFVDSIKHNHGNQIFDLNGQGQSPHTLWIGCSDSRAGDQCLATLP
GEIFVHRNIANIVNANDISSQGVIQFAIDVLKVKKIIVCGHTDCGGIWASLSKKKIGGVL
DLWLNPVRHIRAANLKLLEEYNQDPKLKAKKLAELNVISSVTALKRHPSASVALKKNEIE
VWGMLYDVATGYLSQVEIPQDEFEDLFHVHDEHDEEEYNPH
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| BDBM50216277 |
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| n/a |
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| Name | BDBM50216277 |
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| Synonyms: | 4,4'-((1R,2R,3S,4S)-3,4-dimethylcyclobutane-1,2-diyl)bis(2-methoxyphenol) | 8-beta,8'-alpha-dimethyl-7-alpha,7'-beta-bis(3-methoxy-4-hydroxy-phenyl)cyclobutane | CHEMBL228274 | endiandrin A |
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| Type | Small organic molecule |
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| Emp. Form. | C20H24O4 |
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| Mol. Mass. | 328.4022 |
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| SMILES | COc1cc(ccc1O)[C@@H]1[C@@H](C)[C@H](C)[C@H]1c1ccc(O)c(OC)c1 |r| |
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| Structure | 
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