Unveiling potent Schiff base derivatives with selective xanthine oxidase inhibition: In silico and in vitro approachArticle Published on 2024-04-042024-09-05 Journal: Saudi Pharmaceutical Journal : SPJ [Category] update2024, [키워드] Gout in silico Approach Schiff base triazole Xanthine oxidase inhibition [DOI] 10.1016/j.jsps.2024.102062 PMC 바로가기 [Article Type] Article
Species distribution and antifungal susceptibility profiles of yeasts isolated from onychomycosis: a cross-sectional study with insights into emerging species손톱곰팡이증에서 분리된 효모의 종 분포 및 항진균 감수성 프로필: 신종에 대한 통찰력을 가진 단면 연구Article Published on 2023-12-282024-08-17 Journal: Antonie van Leeuwenhoek [Category] 백선증, [키워드] Antifungal susceptibility profiles Imidazoles Multiplex PCR Onychomycosis triazole
Synthesis, antimycobacterial screening, molecular docking, ADMET prediction and pharmacological evaluation on novel pyran-4-one bearing hydrazone, triazole and isoxazole moieties: Potential inhibitors of SARS CoV-2Article Published on 2023-03-302024-09-05 Journal: Journal of Molecular Structure [Category] update2024, [키워드] hydrazone isoxazole Pre-ADMET Pyranone triazole Tuberculosis [DOI] 10.1016/j.molstruc.2023.135461 PMC 바로가기 [Article Type] Article
Harmicens, Novel Harmine and Ferrocene Hybrids: Design, Synthesis and Biological ActivityArticle Published on 2022-08-182024-08-29 Journal: International Journal of Molecular Sciences [Category] 말라리아, [키워드] amide antiplasmodial antiproliferative Ferrocene harmine hybrid synthesis triazole β-carboline.
Identification of 1,2,3-triazole-phthalimide derivatives as potential drugs against COVID-19: a virtual screening, docking and molecular dynamic studyCOVID-19에 대한 잠재적 약물로서의 1,2,3-트리아졸-프탈이미드 유도체 식별: 가상 스크리닝, 도킹 및 분자 역학 연구Article Published on 2022-08-012022-09-11 Journal: Journal of biomolecular structure & dynamics [Category] SARS, 치료법, [키워드] 123-triazole addition AMES test Analysis Antiviral be positive binding energy calculated complex Compound derivative derivatives docking drug drug candidate drug candidates E35 energy balance exhibited filtered hepatotoxic identification identify in silico inhibitory Interaction investigated M pro MD simulation molecular molecular docking Nucleocapsid proteins other compound other compounds pharmacokinetic phthalimide positive Predictive Prophylaxis protease SARS-CoV-2 SARS-CoV-2 main protease selected target protein target proteins Toxicity toxicity test Treatment triazole Virtual screening [DOI] 10.1080/07391102.2020.1871073 PMC 바로가기 [Article Type] Article
1,2,3-Triazolyl-tetrahydropyrimidine Conjugates as Potential Sterol Carrier Protein-2 Inhibitors: Larvicidal Activity against the Malaria Vector Anopheles arabiensis and In Silico Molecular Docking StudyArticle Published on 2022-04-212024-08-28 Journal: Molecules [Category] 말라리아, [키워드] Anopheles arabiensis Biginelli reaction click chemistry in silico docking Molecular hybridization mosquito larvicidal activity pyrimidine sterol carrier protein-2 triazole
In Silico Identification and Validation of Organic Triazole Based Ligands as Potential Inhibitory Drug Compounds of SARS-CoV-2 Main ProteaseArticle Published on 2021-10-142022-10-30 Journal: Molecules [Category] COVID-19, MERS, SARS, [키워드] activity analyzed anti-SARS-CoV-2 therapeutics bemcentinib binding affinity Bisoctrizole candidate caused collected Compound contagious coronavirus docking drug DrugBank database Human identification in silico analysis inhibiting Interaction M pro macromolecular main protease MD simulation molecular MPro organic pandemic parameter pharmacokinetic polyprotein Potential proportions protease Research SARS-CoV-2 SARS-CoV-2 main protease SARS-CoV-2 virus stability Structure targeted therapy the SARS-CoV-2 the SARS-CoV-2 virus these compound translated triazole validation variants Viral RNA virus were assessed [DOI] 10.3390/molecules26206199 PMC 바로가기 [Article Type] Article
Fungal Genomics in Respiratory Medicine: What, How and When?호흡기 의학의 진균 유전체학: 무엇을, 어떻게, 언제?Review Published on 2021-09-072022-09-10 Journal: Mycopathologia [Category] MERS, SARS, 유전자 메커니즘, 진단, 치료기술, [키워드] acute respiratory distress acute respiratory distress syndrome advance aspergillosis Aspergillus fumigatus azole cause of death caused coronavirus coronavirus disease Coronavirus disease-19 COVID-19 Critical death Diagnosis Diagnostic method diagnostics early diagnosis form fungal Fungal infection fungal infections fungal pathogen fungal pathogens Genomics Health higher risk Immunocompromised patients include Infection infections molecular molecular diagnostics Mortality Mucormycosis Mycoses pathogen Pathogens Patient patient survival pulmonary aspergillosis respiratory respiratory diseases respiratory distress Respiratory distress syndrome respiratory infections resulting shown syndrome treated triazole [DOI] 10.1007/s11046-021-00573-x PMC 바로가기 [Article Type] Review
New quinoline-triazole conjugates: Synthesis, and antiviral properties against SARS-CoV-2Article Published on 2021-06-232023-07-01 Journal: Bioorganic chemistry [Category] SARS, [키워드] click chemistry molecular docking quinoline SARS-CoV-2 triazole [DOI] 10.1016/j.bioorg.2021.105117 PMC 바로가기 [Article Type] Article
Lipophilicity, Pharmacokinetic Properties, and Molecular Docking Study on SARS-CoV-2 Target for Betulin Triazole Derivatives with Attached 1,4-QuinoneArticle Published on 2021-05-232022-10-28 Journal: Pharmaceutics [Category] COVID-19, [키워드] 1,4-quinone Affect Analysis betulin calculate Compound compounds correlation derivative determine influence inhibit lipophilicity membranes MLR molecular docking parameter parameters pharmacokinetic physicochemical property profile Research SARS-CoV-2 SARS-CoV-2 proteins selected similarity target tested triazole [DOI] 10.3390/pharmaceutics13060781 PMC 바로가기 [Article Type] Article