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Recent Submissions
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İntramüsküler enjeksiyon uygulamasında shotblocker kullanımının etkisinin incelenmesi
(Biruni Üniversitesi, 2023)Bu araştırma, intramüsküler enjeksiyon uygulamalarında Shotblocker kullanımının ağrı üzerine etkisini incelemek amacıyla deneysel olarak yapıldı. Araştırma Mayıs 2022 - Ekim 2022 tarihleri arasında İstanbul'da bir eğitim ... -
2019-nCoV virüsüne karşı etkili olabilecek moleküllerin ilaç yeniden yapılandırma ve makine öğrenim yaklaşım yöntemleri ile saptanması
(Biruni Üniversitesi, 2022)Abstract Tez kapsamında virüsün hızla yayılmasını ve kendi kendine replikasyonunu önlemek için SARS-CoV-2'nin yeni inhibitörlerinin bulunması ve inhibitör tasarlamak için derin öğrenme yöntemi kullanılarak RdRp inhibitörü ... -
The effects of morin and methotrexate on pentose phosphatepathway enzymes and GR/GST/TrxR enzyme activities:An in vivo and in silico study
(Wiley, 2023)AbstractIn this study, the mechanisms by which the enzymes glucose‐6‐phosphatedehydrogenase (G6PD), 6‐phosphogluconate dehydrogenase (6PGD), glutathi-one reductase (GR), glutathione‐S‐transferase (GST), and thioredoxin ... -
Structural characterization of TRAF6 N-terminal for therapeutic uses and computational studies on new derivatives
(MDPI, 2023)Abstract: Tumor necrosis factor receptor-associated factors (TRAFs) are a protein family with a wide variety of roles and binding partners. Among them, TRAF6, a ubiquitin ligase, possesses unique receptor binding specificity ... -
Synthesis, anti-inflammatory activity, inverse molecular docking, and acid dissociation constants of new naphthoquinone-thiazole hybrids
(Elsevier, 2023)ABSTRACT Chronic Inflammation is associated with various types of diseases that involves pro-inflammatory cytokines like IL-6 and TNF-α. High costs and serious side effects of available anti-inflammatory/immunomodulatory ... -
Pharmacophore-based virtual screening: Identification of selective sirtuin 2 inhibitors
(Marmara Üniversitesi, 2023)ABSTRACT: The Class III histone deacetylases protein Sirt2 has been implicated in the pathogenesis of several agerelated diseases such as inflammation, cancer, and type II diabetes and is considered an attractive novel ... -
Novel coumarin-chalcone derivatives: Synthesis, characterization, antioxidant, cyclic voltammetry, molecular modelling and biological evaluation studies as acetylcholinesterase, α-glycosidase, and carbonic anhydrase inhibitors
(SpringerLink, 2023)ABSTRACT In this study, a total of 12 coumarin-chalcone derivatives, 6 of which are original were synthesized. The structures of the newly synthesized compounds were elucidated by 1 H NMR, 13C NMR, IR, and elemental analysis ... -
Identification of selective inhibitors for phosphodiesterase 5A using e-pharmacophore modelling and large-scale virtual screening-based structure guided drug discovery approaches
(Taylor & Francis, 2023)ABSTRACT The inhibition of Phosphodiesterase 5A (PDEA5) has the potential to modulate pulmonary arterialhypertension and cardiovascular diseases. Exploring the cross-reactivity of clinically available PDE5Atherapeutics ... -
Novel beta-lactam substituted benzenesulfonamides: in vitro enzyme inhibition, cytotoxic activity and in silico interactions
(Taylor & Francis, 2023)Abstract Abstract : In this study, a library of twelve beta-lactam-substituted benzenesulfonamides (5a–l) was synthesized using the tail-approach method. The compounds were characterized using IR, 1H NMR, 13C NMR and ... -
The discovery of potential cyclin A/CDK2 inhibitors: a combination of 3D QSAR pharmacophore modeling, virtual screening, and molecular docking studies
(SpringerLink, 2013)Abstract Cyclin-dependent kinases are a family of enzymes that regulates the cell cycle process. They have been found to be novel targets for potential anti-cancer drugs. In the present study, a 3D pharmacophore model has ... -
Design, synthesis, and evaluation of a new series of hydrazones as small-molecule akt inhibitors for NSCLC therapy
(American Chemical Society, 2023)Abstract In an endeavor to identify small molecules for the managementofnon-small-cell lung carcinoma, 10 new hydrazone derivatives (3a-j) were synthesized. MTT test was conducted to examinetheir cytotoxic activities ... -
Structural characterization and biological evaluation of uracil-appended benzylic amines as acetylcholinesterase and carbonic anhydrase I and II inhibitors
(Elsevier, 2023)Abstract A series of novel uracil-appended benzylic amines were synthesized through reductive amination with moderate to good yields (30–84% yields). In situ prepared 5-(arylidene)-6-aminouracils with the condensation ... -
Computer-aided drug design
(BMC, 2023)Abstract Computer-Aided Drug Design tools are now an indispensable part of drug discovery that have made key contributions to the development of drugs. In this editorial, I briefly provide an overview of CADD emphasizing ... -
Investigating the activity of indole-2-on derivative src kinase inhibitors against chronic myeloid leukemia cells
(Bentham Science Publishers, 2023)Background: Src family tyrosine kinases play a potential role in Bcr-Abl-induced leukemogenesis. Src kinase inhibitors are reported as selective inhibitors of chronic myeloid leukemia. Objective: Since Src kinase inhibitors ... -
Modeling disruption of Apis mellifera (honey bee) odorant-binding protein function with high-affinity binders
(Wiley, 2023)Chemical toxins pose a great threat to honey bee health because they affect memory and cognition, diminish immunity, and increase susceptibility to infection, resulting in decreased colony performance, reproduction, and ... -
Synthesis of benzimidazole-1,2,4- triazole derivatives as potential antifungal agents targeting 14α-demethylase
(American Chemical Society, 2023)Invasive fungal infections (IFIs) are increasing as major infectious diseases around the world, and the limited efficacy of existing medications has resulted in substantial morbidity and death in patients due to the lack ... -
A new series of thiazole‐hydrazone hybrids for Akt‐targeted therapy of non‐small cell lung cancer
(Wiley, 2022)In an attempt to identify potent antitumor agents for the fight against non‐small cell lung cancer, new thiazolyl hydrazones (2a–n) were synthesized and examined for their in vitro cytotoxic effects on A549 human lung ... -
Cytotoxic activity and docking studies of 2-arenoxybenzaldehyde n-acyl hydrazone and 1,3,4-oxadiazole derivatives against various cancer cell lines
(Multidisciplinary Digital Publishing Institute (MDPI), 2022)Abstract To understand whether previously synthesized novel hydrazone and oxadiazole derivatives have promising anticancer effects, docking studies and in vitro toxicity assays were performed on A-549, MDA-MB-231, and PC-3 ... -
Indane based molecular motors: UV-switching increases number of isomers
(Multidisciplinary Digital Publishing Institute (MDPI), 2022)Abstract: We describe azophenylindane based molecular motors (aphin-switches) which have two different rotamers of trans-configuration and four different rotamers of cis-configuration. The behaviors of these motors were ... -
Comprehensive study on potent and selective carbonic anhydrase inhibitors: Synthesis, bioactivities and molecular modelling studies of 4-(3-(2-arylidenehydrazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazole-1-yl) benzenesulfonamides
(Elsevier, 2021)Abstract In this research, rational design, synthesis, carbonic anhydrases (CAs) inhibitory effects, and cytotoxicities of the 4-(3-(2-arylidenehydrazine-1-carbonyl)-5-(thiophen-2-yl)-1H-pyrazole-1-yl)benzenesulfonamides ...
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