Reaction Details | |||
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Target | Carbonic anhydrase | ||
Ligand | BDBM25914 | ||
Substrate/Competitor | n/a | ||
Meas. Tech. | ChEMBL_626038 (CHEMBL1106166) | ||
Ki | 81±n/a nM | ||
Citation | Güzel, O; Maresca, A; Hall, RA; Scozzafava, A; Mastrolorenzo, A; Mühlschlegel, FA; Supuran, CT Carbonic anhydrase inhibitors. The beta-carbonic anhydrases from the fungal pathogens Cryptococcus neoformans and Candida albicans are strongly inhibited by substituted-phenyl-1H-indole-5-sulfonamides. Bioorg Med Chem Lett20:2508-11 (2010) [PubMed] Article | ||
More Info.: | Get all data from this article, Assay Method | ||
Carbonic anhydrase | |||
Name: | Carbonic anhydrase | ||
Synonyms: | CAN_CANAL | NCE103 | beta-Carbonic Anhydrase | ||
Type: | Enzyme | ||
Mol. Mass.: | 31587.59 | ||
Organism: | Candida albicans (Yeast) | ||
Description: | n/a | ||
Residue: | 281 | ||
Sequence: |
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BDBM25914 | |||
n/a | |||
Name | BDBM25914 | ||
Synonyms: | 3-(2-bromophenyl)-2-(hydrazinecarbonyl)-1H-indole-5-sulfonamide | BMC173212 Compound 2j | indole sulfonamide, 8j | ||
Type | Small organic molecule | ||
Emp. Form. | C15H13BrN4O3S | ||
Mol. Mass. | 409.258 | ||
SMILES | NNC(=O)c1[nH]c2ccc(cc2c1-c1ccccc1Br)S(N)(=O)=O |(3.59,5.07,;2.05,5.07,;1.28,3.73,;2.05,2.4,;-.26,3.73,;-1.17,2.49,;-2.63,2.96,;-3.97,2.19,;-5.3,2.96,;-5.3,4.5,;-3.97,5.27,;-2.63,4.5,;-1.17,4.98,;-.69,6.44,;.79,6.86,;1.17,8.36,;.06,9.43,;-1.42,9.01,;-1.8,7.52,;-3.28,7.1,;-6.63,5.27,;-7.97,6.04,;-5.86,6.61,;-7.4,3.94,)| | ||
Structure |