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Enzyme inhibitory potential of some indole Schiff bases on acetylcholinesterase and human carbonic anhydrase isoforms I and II enzymes: an in vitro and molecular docking study

Journal of Biomolecular Structure and Dynamics · Ocak 2023

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YÖKSİS Kayıtları
Enzyme inhibitory potential of some indole Schiff bases on acetylcholinesterase and human carbonic anhydrase isoforms I and II enzymes: an in vitro and molecular docking study
Journal of Biomolecular Structure and Dynamics · 2023 SCI-Expanded
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Makale Bilgileri

DergiJournal of Biomolecular Structure and Dynamics
Yayın TarihiOcak 2023
Özet In this study, the in vitro effects of some indole Schiff bases on acetylcholinesterase and human carbonic anhydrase isoforms I and II were investigated. A series of N-methylindole hydrazide/hydrazone derivatives (1a-1t) were tested on these enzymes. The interactions of the synthesized indole derivatives with target enzymes were studied by molecular docking methodology. The results revealed that indole derivative Schiff base compounds inhibited the enzymes significantly. Ki values for hCAI isoenzyme were determined to be in the range of 36.18 ± 3.07–224.29 ± 5.78 nM; for the hCAII isoenzyme in the range of 31.30 ± 2.63–201.64 ± 7.25 nM; for acetylcholinesterase in the range of 6.82 ± 0.72–110.30 ± 9.26 nM. Compared to the control compound Acetazolamide (AZA), 1k and 1p were found to have the best inhibitory effect for hCAI; 1p was found to be the best inhibitory effect for hCAII. Compared to the control compound Tacrine (TAC), 1s showed the best inhibitory effect for AChE. In vitro results were verified with the results obtained by docking studies and interactions with enzymes were demonstrated. Communicated by Ramaswamy H. Sarma.

Yazarlar (5)

1
Ebru Akman
2
Hanif Şirinzade
3
Serap Yilmaz Ozguven
4
Esra Dilek
5
Sibel Süzen

Anahtar Kelimeler

Acetylcholinesterase enzyme inhibition human carbonic anhydrase isoforms I and II indole schiff bases molecular docking

Kurumlar

Ankara Üniversitesi
Ankara Turkey
Erzincan Binali Yıldırım Üniversitesi
Erzincan Turkey
Selçuk Üniversitesi
Selçuklu Turkey
Trakya Üniversitesi
Edirne Turkey

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1
Atıf
5
Yazar
5
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