Antimicrobial and in-silico evaluation of novel chalcone and amide-linked 1,4-disubstituted 1,2,3 triazoles

Design and Synthesis of Novel Imidazole Derivatives Possessing Triazole Pharmacophore with Potent Anticancer Activity, and In Silico ADMET with GSK-3β Molecular Docking Investigations

(2021) Fawzia Al-blewi et al.   INTERNATIONAL JOURNAL OF MOLECULAR SCIENCES

Synthesis, antibacterial evaluation and computational studies of new acridone-1,2,3-triazole hybrids

(2021) Mohammed Aarjane et al.   JOURNAL OF MOLECULAR STRUCTURE

Novel 1,2,3‐Triazole Derivatives as Potential Inhibitors against Covid‐19 Main Protease: Synthesis, Characterization, Molecular Docking and DFT Studies

(2021) Mohamed Reda Aouad et al.   ChemistrySelect

Anti-COVID-19 activity of some benzofused 1,2,3-triazolesulfonamide hybrids using in silico and in vitro analyses

(2021) Abdullah Y. Alzahrani et al.   CHEMOMETRICS AND INTELLIGENT LABORATORY SYSTEMS

Current trends in computer aided drug design and a highlight of drugs discovered via computational techniques: A review

(2021) Victor T. Sabe et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Synthesis, Docking, and Biological activities of novel Metacetamol embedded [1,2,3]-triazole derivatives

(2021) Hima Bindhu Joolakanti et al.   JOURNAL OF MOLECULAR STRUCTURE

Discovery of triaromatic flexible agents bearing 1,2,3-Triazole with selective and potent anti-breast cancer activity and CDK9 inhibition supported by molecular dynamics

(2021) Saleh K. Ihmaid et al.   JOURNAL OF MOLECULAR STRUCTURE

Primary discovery of 1-aryl-5-substituted-1H-1,2,3-triazole-4-carboxamides as promising antimicrobial agents

(2021) Nazariy Pokhodylo et al.   JOURNAL OF MOLECULAR STRUCTURE

Chalcone synthesis, properties and medicinal applications: a review

(2020) Aluru Rammohan et al.   Environmental Chemistry Letters

Novel scaffold hopping of potent benzothiazole and isatin analogues linked to 1,2,3-triazole fragment that mimic quinazoline epidermal growth factor receptor inhibitors: Synthesis, antitumor and mechanistic analyses

(2020) Nadjet Rezki et al.   BIOORGANIC CHEMISTRY

Synthesis, Characterization, DNA Binding, Docking, and Anticancer Studies of Novel Bis‐1,2,3‐triazoles Phthalonitrile

(2020) Shaya Yahya Alraqa et al.   ChemistrySelect

Design, synthesis, DNA binding, modeling, anticancer studies and DFT calculations of Schiff bases tethering benzothiazole-1,2,3-triazole conjugates

(2020) Meshal A. Almehmadi et al.   JOURNAL OF MOLECULAR STRUCTURE

Design, click conventional and microwave syntheses, DNA binding, docking and anticancer studies of benzotriazole-1,2,3-triazole molecular hybrids with different pharmacophores

(2020) Shaya Yahya Alraqa et al.   JOURNAL OF MOLECULAR STRUCTURE

Anti-cancer potential of novel glycosylated 1,4-substituted triazolylchalcone derivatives

(2019) Tapasi Manna et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

Design, synthesis, characterization, antimicrobial evaluation and molecular modeling studies of some dehydroacetic acid-chalcone-1,2,3-triazole hybrids

(2018) Kashmiri Lal et al.   BIOORGANIC CHEMISTRY

Synthesis, crystal structure and antimicrobial potential of some fluorinated chalcone-1,2,3-triazole conjugates

(2018) Pinki Yadav et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Synthesis and Antimalarial Evaluation of [1, 2,3]-Triazole-Tethered Sulfonamide-Berberine Hybrids

(2018) Neha Batra et al.   ChemistrySelect

Targeting Antibiotic Resistance

(2016) Mathieu F. Chellat et al.   ANGEWANDTE CHEMIE-INTERNATIONAL EDITION

Mechanisms and consequences of bacterial resistance to antimicrobial peptides

(2016) D.I. Andersson et al.   DRUG RESISTANCE UPDATES

Synthesis of newer 1,2,3-triazole linked chalcone and flavone hybrid compounds and evaluation of their antimicrobial and cytotoxic activities

(2016) Rama Kant et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Synthesis, antimicrobial activity, and QSAR studies of amide-ester linked 1,4-disubstituted 1,2,3-triazoles

(2016) C. P. Kaushik et al.   MONATSHEFTE FUR CHEMIE

Enhancing the anti-inflammatory activity of chalcones by tuning the Michael acceptor site

(2015) Hannelore Rücker et al.   ORGANIC & BIOMOLECULAR CHEMISTRY

Synthesis and Anti-HIV Activity of Triazolo-Fused, Medium-Sized Cyclic Nucleoside Analogs Prepared by an IntramolecularHuisgen1,3-Dipolar Cycloaddition

(2014) Jingbo Sun et al.   HELVETICA CHIMICA ACTA

Synthesis and Antifungal Activity of Benzamidine Derivatives Carrying 1,2,3-Triazole Moieties

(2014) Guangyou Chen et al.   MOLECULES

Advancements in the mechanistic understanding of the copper-catalyzed azide–alkyne cycloaddition

(2013) Regina Berg et al.   Beilstein Journal of Organic Chemistry

Software and resources for computational medicinal chemistry

(2011) Chenzhong Liao et al.   Future Medicinal Chemistry

Structure–Activity Relationship Studies of Sulfonylpiperazine Analogues as Novel Negative Allosteric Modulators of Human Neuronal Nicotinic Receptors

(2011) Brandon J. Henderson et al.   JOURNAL OF MEDICINAL CHEMISTRY

Synthesis of novel sulfanilamide-derived 1,2,3-triazoles and their evaluation for antibacterial and antifungal activities

(2010) Xian-Long Wang et al.   EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY

Prediction of Absolute Solvation Free Energies using Molecular Dynamics Free Energy Perturbation and the OPLS Force Field

(2010) Devleena Shivakumar et al.   Journal of Chemical Theory and Computation

Antibiotic resistance and its cost: is it possible to reverse resistance?

(2010) Dan I. Andersson et al.   NATURE REVIEWS MICROBIOLOGY

Synthesis, antimalarial and antitubercular activity of acetylenic chalcones

(2009) Renate H. Hans et al.   BIOORGANIC & MEDICINAL CHEMISTRY LETTERS

OLEX2: a complete structure solution, refinement and analysis program

(2009) Oleg V. Dolomanov et al.   JOURNAL OF APPLIED CRYSTALLOGRAPHY

AutoDock4 and AutoDockTools4: Automated docking with selective receptor flexibility

(2009) Garrett M. Morris et al.   JOURNAL OF COMPUTATIONAL CHEMISTRY