Cargando…

Investigation of embelin synthetic hybrids as potential COVID-19 and COX inhibitors: Synthesis, spectral analysis, DFT calculations and molecular docking studies

Embelin (2, 5-dihydroxy-3-undecyl-1,4-benzoquinone), a benzoquinone isolated from fruits of Embelia ribes has miscellaneous biological potentials including; anticancer, anti-inflammation, antibiotic, and anti-hyperglycemic activities. Also, embelin down-regulates the overexpression of inflammatory p...

Descripción completa

Detalles Bibliográficos
Autores principales:	Mathada, Basavarajaiah Suliphuldevara, Basha, N. Jeelan, Karunakar, Prashantha, Periyasamy, Ganga, Somappa, Sasidhar B., Javeed, Mohammad, Vanishree, S.
Formato:	Online Artículo Texto
Lenguaje:	English
Publicado:	Elsevier B.V. 2023
Materias:	Article
Acceso en línea:	https://www.ncbi.nlm.nih.gov/pmc/articles/PMC9575004/ https://www.ncbi.nlm.nih.gov/pubmed/36277303 http://dx.doi.org/10.1016/j.molstruc.2022.134356

Ejemplares similares

An insight into the recent developments in anti-infective potential of indole and associated hybrids()
por: Mathada, Basavarajaiah Suliphuldevara, et al.
Publicado: (2022)

Therapeutic potential of pyrrole and pyrrolidine analogs: an update
por: Jeelan Basha, N., et al.
Publicado: (2022)

Molecular docking analysis of COX-2 for potential inhibitors
por: Selvaraj, Jayaraman, et al.
Publicado: (2020)

Stress Degradation Studies on Embelin
por: Ferreira, Galvina, et al.
Publicado: (2013)

Molecular docking analysis of COX-2 with compounds from Piper longum
por: Tripathi, Dhirendra, et al.
Publicado: (2021)

Synthesis, DFT Calculations, Antiproliferative, Bactericidal Activity and Molecular Docking of Novel Mixed-Ligand Salen/8-Hydroxyquinoline Metal Complexes
por: Al-Farhan, Badriah Saad, et al.
Publicado: (2021)

The Application of Embelin for Cancer Prevention and Therapy †
por: Ko, Jeong-Hyeon, et al.
Publicado: (2018)

Investigation of Some Antiviral N-Heterocycles as COVID 19 Drug: Molecular Docking and DFT Calculations
por: Hagar, Mohamed, et al.
Publicado: (2020)

Molecular docking data of piperine with Bax, Caspase 3, Cox 2 and Caspase 9
por: Kirubhanand, Chandrasekaran, et al.
Publicado: (2020)

Searching potential antiviral candidates for the treatment of the 2019 novel coronavirus based on DFT calculations and molecular docking
por: Sagaama, Abir, et al.
Publicado: (2020)

New thiazole, pyridine and pyrazole derivatives as antioxidant candidates: synthesis, DFT calculations and molecular docking study
por: Kaddouri, Yassine, et al.
Publicado: (2020)

An unexpected single crystal structure of nickel(II) complex: Spectral, DFT, NLO, magnetic and molecular docking studies
por: Derafa, Wassila, et al.
Publicado: (2022)

XIAP Antagonist Embelin Inhibited Proliferation of Cholangiocarcinoma Cells
por: Wehrkamp, Cody J., et al.
Publicado: (2014)

Embelin binds to human neuroserpin and impairs its polymerisation
por: Saga, Giorgia, et al.
Publicado: (2016)

Anti-plasmodial and Chloroquine Resistance Suppressive Effects of Embelin
por: Zaid, O.I., et al.
Publicado: (2017)

Embelin as Lead Compound for New Neuroserpin Polymerization Inhibitors
por: Visentin, Cristina, et al.
Publicado: (2020)

Pharmacological evaluation of embelin - chitosan nanoparticles as an antidiabetic agent
por: Maanvizhi, Saba, et al.
Publicado: (2022)

Synthesis of Quinoline and Dihydroquinoline Embelin Derivatives as Cardioprotective Agents
por: Martín-Acosta, Pedro, et al.
Publicado: (2023)

Experimental spectral characterization, Hirshfeld surface analysis, DFT/TD-DFT calculations and docking studies of (2Z,5Z)-5-(4-nitrobenzylidene)-3-N(2-methoxyphenyl)-2-N’(2-methoxyphenylimino) thiazolidin-4-one
por: Djafri, Ahmed, et al.
Publicado: (2020)

Revisiting Activity of Some Nocodazole Analogues as a Potential Anticancer Drugs Using Molecular Docking and DFT Calculations
por: Khattab, Muhammad, et al.
Publicado: (2021)

Antimicrobial Activity, DFT Calculations, and Molecular Docking of Dialdehyde Cellulose/Graphene Oxide Film Against Covid-19
por: Dacrory, Sawsan
Publicado: (2021)

In silico study of remdesivir with and without ionic liquids having different cations using DFT calculations and molecular docking
por: Kumari, Kamlesh, et al.
Publicado: (2022)

Efficient One-Pot Synthesis of Indolhydroxy Derivatives Catalyzed by SnCl(2), DFT Calculations and Docking Study
por: Hakmaoui, Yassine, et al.
Publicado: (2022)

Synthesis, spectroscopic, DFT calculations, biological activity, SAR, and molecular docking studies of novel bioactive pyridine derivatives
por: Anwer, Kurls E., et al.
Publicado: (2023)

A Mini Library of Novel Triazolothiadiazepinylindole Analogues: Synthesis, Antioxidant and Antimicrobial Evaluations
por: Biradar, Jaiprakash Sharanappa, et al.
Publicado: (2014)

A TLC Identification and Spectrophotometric Estimation of Embelin in Embelia ribes
por: Chauhan, S. K., et al.
Publicado: (1999)

Embelin and levodopa combination therapy for improved Parkinson’s disease treatment
por: Ramachandra, Vagdevi Hangarakatte, et al.
Publicado: (2022)

DFT and molecular docking investigations of oxicam derivatives
por: Mary, Y.Shyma, et al.
Publicado: (2019)

X-ray Crystallography, DFT Calculations and Molecular Docking of Indole-Arylpiperazine Derivatives as α(1A)-Adrenoceptor Antagonists
por: Xu, Wei, et al.
Publicado: (2015)

Biological Evaluation, DFT Calculations and Molecular Docking Studies on the Antidepressant and Cytotoxicity Activities of Cycas pectinata Buch.-Ham. Compounds
por: Rahman, Jinnat, et al.
Publicado: (2020)

Synthesis of 1,2,4-Trisubstituted-(1H)-imidazoles through Cu(OTf)(2)-/I(2)-Catalyzed C–C Bond Cleavage of Chalcones and Benzylamines
por: Salfeena, Chettiyan Thodi F., et al.
Publicado: (2018)

Tropinone-Derived Alkaloids as Potent Anticancer Agents: Synthesis, Tyrosinase Inhibition, Mechanism of Action, DFT Calculation, and Molecular Docking Studies
por: Piechowska, Katarzyna, et al.
Publicado: (2020)

Fabrication, DFT Calculation, and Molecular Docking of Two Fe(III) Imine Chelates as Anti-COVID-19 and Pharmaceutical Drug Candidate
por: El-Lateef, Hany M. Abd, et al.
Publicado: (2022)

Macrophage targeting contributes to the inhibitory effects of embelin on colitis-associated cancer
por: Wu, Ting, et al.
Publicado: (2016)

Embelin Restores Carbapenem Efficacy against NDM-1-Positive Pathogens
por: Ning, Nian-Zhi, et al.
Publicado: (2018)

Plant Derived Phytocompound, Embelin in CNS Disorders: A Systematic Review
por: Kundap, Uday P., et al.
Publicado: (2017)

Pharmacokinetic and Bioavailability Studies of Embelin after Intravenous and Oral Administration to Rats
por: Li, Zhen, et al.
Publicado: (2019)

Efficient Multicomponent Synthesis of Diverse Antibacterial Embelin-Privileged Structure Conjugates
por: Martín-Acosta, Pedro, et al.
Publicado: (2020)

Design, synthesis and α-glucosidase inhibition study of novel embelin derivatives
por: Chen, Xiaole, et al.
Publicado: (2020)

Synthesis, spectral analysis, molecular docking and DFT studies of 3-(2, 6-dichlorophenyl)-acrylamide and its dimer through QTAIM approach
por: Shukla, Akhilesh Kumar, et al.
Publicado: (2020)

Cannot write session to /tmp/vufind_sessions/sess_47pbjsg9vcri93sop8k7uqdev0