Dynamics of small molecule-enzyme interactions: Novel benzenesulfonamides as multi-target agents endowed with inhibitory effects against some metabolic enzymes

Güleç, Özcan; Türkeş, Cüneyt; Arslan, Mustafa; Işık, Mesut; Demir, Yeliz; Duran, Hatice Esra; Fırat, Muhammet; Küfrevioğlu, Ömer İrfan; Beydemir, Şükrü

doi:10.1016/j.abb.2024.110099

Archives of Biochemistry and Biophysics

2024

DOI: 10.1016/j.abb.2024.110099

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Dynamics of small molecule-enzyme interactions: Novel benzenesulfonamides as multi-target agents endowed with inhibitory effects against some metabolic enzymes

Özcan Güleç,

Cüneyt Türkeş,

Mustafa Arslan

et al.

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2024

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Cited by 9 publications

References 83 publications

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LC‐HRMS Profiling of Phytochemicals with Assessment of Antioxidant, Anticholinesterase, and Antimicrobial Potentials of Astragalus Brachystachys DC

Ersoy,

Boga,

Kaplan

et al. 2024

Chemistry & Biodiversity

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This study provides the first comprehensive report on the chemical constituents and biological activities of an important medicinal plant, Astragalus brachystachys DC. The aerial part samples were collected from Adana, Türkiye, and an ethanol extract was prepared with these parts. The secondary metabolites of the extract were determined by an LC‐HRMS analysis. The LC‐HRMS analysis showed the presence of 39 different constituents, hyperoside (303.419±10.50 μg/g extract), p‐coumaric acid (256.975±8.51 μg/g extract), and rutin (72.684±2.23 μg/g extract) were determined as major compounds in the aerial parts ethanol extract. Attributed to its high total phenolic (58.53±1.30 μg PEs/mg extract) and total flavonoid content (29.98±0.83 μg QEs/mg extract), the extract demonstrated strong antioxidant activity according to three different assays namely DPPH free (IC50: 33.08±0.61 mg/mL), and ABTS cation radical scavenging (IC50: 15.39±0.72 mg/mL) and CUPRAC activity (A0.5: 36.25±0.28 mg/mL) methods. In vitro assays showed that cholinesterase inhibitory activity results were found to be exceptional with 85.95±0.52 % inhibition on acetylcholinesterase and 66.32±1.33 % inhibition on butyrylcholinesterase at 200 mg/mL. Regarding antimicrobial properties, Astragalus brachystachys DC extract was found to be effective against Enterococcus faecalis with a MIC value of 39.06 μg/mL.

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LC‐HRMS Profiling of Phytochemicals with Assessment of Antioxidant, Anticholinesterase, and Antimicrobial Potentials of Astragalus Brachystachys DC

Ersoy,

Boga,

Kaplan

et al. 2024

Chemistry & Biodiversity

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In Vivo Screening and In Silico Structure-Based Characterization of Synthesized Oxadiazole Derivatives with Potential Anticonvulsant Activity

Patil,

2024

Chemistry Africa

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Computational insights into human UCP1 activators through molecular docking, MM-GBSA, and molecular dynamics simulation studies

Jagtap,

Rathod,

Shukla

et al. 2024

Computational Biology and Chemistry

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Dynamics of small molecule-enzyme interactions: Novel benzenesulfonamides as multi-target agents endowed with inhibitory effects against some metabolic enzymes

Cited by 9 publications

References 83 publications

LC‐HRMS Profiling of Phytochemicals with Assessment of Antioxidant, Anticholinesterase, and Antimicrobial Potentials of Astragalus Brachystachys DC

LC‐HRMS Profiling of Phytochemicals with Assessment of Antioxidant, Anticholinesterase, and Antimicrobial Potentials of Astragalus Brachystachys DC

In Vivo Screening and In Silico Structure-Based Characterization of Synthesized Oxadiazole Derivatives with Potential Anticonvulsant Activity

Computational insights into human UCP1 activators through molecular docking, MM-GBSA, and molecular dynamics simulation studies

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