| Literature DB >> 34387019 |
Fevzi Topal1, Kadir Aksu2, Ilhami Gulcin3, Ferhan Tümer4, Süleyman Goksu3.
Abstract
In this work, the inhibitory effect of some symmetric sulfamides derived from phenethylamines were determined against human carbonic anhydrase (hCA) I, and II isoenzymes, and compared with standard compound acetazolamide. IC50 values were obtained from the Enzyme activity (%)-[Symmetric sulfamides] graphs. Also, Ki values were calculated from the Lineweaver-Burk graphs. Some symmetric sulfamides compounds (11-18) demonstrated excellent inhibition effects against hCA I, and II isoenzymes. These compounds demonstrated effective inhibitory profiles with IC50 values in ranging from 21.66-28.88 nM against hCA I, 14.44-30.13 nM against hCA II. Among these compounds, the best Ki value for hCA I (Ki : 8.34±1.60 nM) and hCA II (Ki : 16.40±1.00 nM) is compound number 11. Besides, the IC50 value of acetazolamide used as a standard was determined as hCA I, hCA II 57.75 nM, 49.50 nM, respectively. Moreover, in silico ADME-Tox study showed that all synthesized compounds (11-18) had good oral bioavailability in light of Jorgensen's rule of three, and of Lipinski's rule of five.Entities:
Keywords: ADME-Tox; Carbonic anhydrase; enzyme inhibition; phenethylamine; sulfamide
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Year: 2021 PMID: 34387019 DOI: 10.1002/cbdv.202100422
Source DB: PubMed Journal: Chem Biodivers ISSN: 1612-1872 Impact factor: 2.408