FRINK Linked Data Fragments server

Matches in SemOpenAlex for { <https://semopenalex.org/work/W4293764283> ?p ?o ?g. }

• W4293764283 endingPage "110134" @default.
• W4293764283 startingPage "110134" @default.
• W4293764283 abstract "Eight new aminothiols (4a-g and 5) and three new sulfonic acid derivatives (6a-c) were synthesized, and their structures were characterized. Inhibitory effects of the obtained compounds on carbonic anhydrase I and II isoforms (hCA I and hCA II), butyrylcholinesterase (BChE) and acetylcholinesterase (AChE), enzymes were investigated. The newly synthesized compounds have inhibited hCA I with Kis ranging from 7.11 ± 1.46 nM (6a) to 670.52 ± 300.41 nM (4b) and, hCA II with Kis ranging from 16.83 ± 5.72 nM (6a) to 453.34 ± 208.56 nM (4c). Acetazolamide was employed as the positive control for both hCA isoforms (Ki for hCA I 198.81 ± 14.13 nM and Ki for hCA II 211.42 ± 13.10 nM), and among the new compounds obtained, it was observed that there were compounds that were active at much lower nM levels. All compounds were also evaluated for inhibition of AChE and BChE. They inhibited AChE and BChE enzymes in the range of Ki 5.24 ± 2.27 (6c) - 48.44 ± 21.82 (4g) for AChE and 4.86 ± 0.64 (6c) - 51.75 ± 12.56 (4a) for BChE, and the results were compared with the standard inhibitor Tacrine (Ki: 14.20 ± 8.83 nM toward AChE and Ki: 3.39 ± 1.91 nM for BChE). Cholinesterase (BChE and AChE) inhibitory abilities of all synthesized molecules were also performed in situ and molecular docking and molecular dynamics (MD) simulation studies. The molecular coupling scores of the compounds and the free binding energies calculated by MM/GBSA were found to be compatible. Examining the results obtained from this study shows that it may have the potential to develop new drugs to treat some global patients such as glaucoma and Alzheimer's disease (AD)." @default.
• W4293764283 created "2022-08-31" @default.
• W4293764283 creator A5005093487 @default.
• W4293764283 creator A5010616600 @default.
• W4293764283 creator A5017753019 @default.
• W4293764283 creator A5050370140 @default.
• W4293764283 creator A5063247477 @default.
• W4293764283 creator A5070097232 @default.
• W4293764283 date "2022-10-01" @default.
• W4293764283 modified "2023-10-02" @default.
• W4293764283 title "Synthesis, characterization, evaluation of metabolic enzyme inhibitors and in silico studies of thymol based 2-amino thiol and sulfonic acid compounds" @default.
• W4293764283 cites W1970578669 @default.
• W4293764283 cites W1971048984 @default.
• W4293764283 cites W1989592329 @default.
• W4293764283 cites W1989860115 @default.
• W4293764283 cites W1995920838 @default.
• W4293764283 cites W1997055997 @default.
• W4293764283 cites W2002236575 @default.
• W4293764283 cites W2015473548 @default.
• W4293764283 cites W2030859136 @default.
• W4293764283 cites W2031625403 @default.
• W4293764283 cites W2044930178 @default.
• W4293764283 cites W2045927961 @default.
• W4293764283 cites W2047178318 @default.
• W4293764283 cites W2047420624 @default.
• W4293764283 cites W2073260568 @default.
• W4293764283 cites W2077160294 @default.
• W4293764283 cites W2083228186 @default.
• W4293764283 cites W2088145736 @default.
• W4293764283 cites W2088350865 @default.
• W4293764283 cites W2100837269 @default.
• W4293764283 cites W2118831097 @default.
• W4293764283 cites W2126659096 @default.
• W4293764283 cites W2134965181 @default.
• W4293764283 cites W2175058752 @default.
• W4293764283 cites W2343503409 @default.
• W4293764283 cites W2597990638 @default.
• W4293764283 cites W2618953123 @default.
• W4293764283 cites W2739872856 @default.
• W4293764283 cites W2801950667 @default.
• W4293764283 cites W2804344418 @default.
• W4293764283 cites W2883961679 @default.
• W4293764283 cites W2885024660 @default.
• W4293764283 cites W2885235170 @default.
• W4293764283 cites W2885378005 @default.
• W4293764283 cites W2886970149 @default.
• W4293764283 cites W2894762984 @default.
• W4293764283 cites W2898939772 @default.
• W4293764283 cites W2903095195 @default.
• W4293764283 cites W2906081536 @default.
• W4293764283 cites W2911657223 @default.
• W4293764283 cites W2921843036 @default.
• W4293764283 cites W2938184219 @default.
• W4293764283 cites W2944620151 @default.
• W4293764283 cites W2947397550 @default.
• W4293764283 cites W2947671199 @default.
• W4293764283 cites W2950787484 @default.
• W4293764283 cites W2953806257 @default.
• W4293764283 cites W2954402636 @default.
• W4293764283 cites W2963719304 @default.
• W4293764283 cites W2976332867 @default.
• W4293764283 cites W2990272984 @default.
• W4293764283 cites W2990795604 @default.
• W4293764283 cites W2995445122 @default.
• W4293764283 cites W2997392685 @default.
• W4293764283 cites W3000555966 @default.
• W4293764283 cites W3000975011 @default.
• W4293764283 cites W3004344112 @default.
• W4293764283 cites W3006028428 @default.
• W4293764283 cites W3010454213 @default.
• W4293764283 cites W3010981453 @default.
• W4293764283 cites W3018490473 @default.
• W4293764283 cites W3019261188 @default.
• W4293764283 cites W3023781176 @default.
• W4293764283 cites W3026196989 @default.
• W4293764283 cites W3028544576 @default.
• W4293764283 cites W3034598807 @default.
• W4293764283 cites W3044019810 @default.
• W4293764283 cites W3087654166 @default.
• W4293764283 cites W3087876799 @default.
• W4293764283 cites W3092387764 @default.
• W4293764283 cites W3096775377 @default.
• W4293764283 cites W3106873016 @default.
• W4293764283 cites W4235954877 @default.
• W4293764283 cites W4246067442 @default.
• W4293764283 doi "https://doi.org/10.1016/j.cbi.2022.110134" @default.
• W4293764283 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/36057360" @default.
• W4293764283 hasPublicationYear "2022" @default.
• W4293764283 type Work @default.
• W4293764283 citedByCount "7" @default.
• W4293764283 countsByYear W42937642832023 @default.
• W4293764283 crossrefType "journal-article" @default.
• W4293764283 hasAuthorship W4293764283A5005093487 @default.
• W4293764283 hasAuthorship W4293764283A5010616600 @default.
• W4293764283 hasAuthorship W4293764283A5017753019 @default.
• W4293764283 hasAuthorship W4293764283A5050370140 @default.
• W4293764283 hasAuthorship W4293764283A5063247477 @default.
• W4293764283 hasAuthorship W4293764283A5070097232 @default.

• next