Herbal compounds for rheumatoid arthritis: Literatures review and cheminformatics prediction
Sign Up to like & getrecommendations! Published in 2019 at "Phytotherapy Research"
DOI: 10.1002/ptr.6509
Abstract: Rheumatoid arthritis (RA) is a systemic disease characterized by autoimmunity, joint inflammation, and cartilage destruction, which affects 0.5–1% of the population. Many compounds from herbal medicines show the potentials to treat RA. On this basis,… read more here.
Keywords: drug likeness; likeness properties; rheumatoid arthritis; herbal compounds ... See more keywords
Repurposing of phytomedicine-derived bioactive compounds with promising anti-SARS-CoV-2 potential: Molecular docking, MD simulation and drug-likeness/ADMET studies
Sign Up to like & getrecommendations! Published in 2021 at "Saudi Journal of Biological Sciences"
DOI: 10.1016/j.sjbs.2021.12.018
Abstract: In view of the potential of traditional plant-based remedies (or phytomedicines) in the management of COVID-19, the present investigation was aimed at finding novel anti-SARS-CoV-2 molecules by in silico screening of bioactive phytochemicals (database) using… read more here.
Keywords: drug likeness; sars cov; likeness admet; anti sars ... See more keywords
Improving the drug-likeness of inspiring natural products - evaluation of the antiparasitic activity against Trypanosoma cruzi through semi-synthetic and simplified analogues of licarin A
Sign Up to like & getrecommendations! Published in 2020 at "Scientific Reports"
DOI: 10.1038/s41598-020-62352-w
Abstract: Neolignan licarin A (1) was isolated from leaves of Nectandra oppositifolia (Lauraceae) and displayed activity against trypomastigote forms of the etiologic agent of American trypanosomiasis, Trypanosoma cruzi. Aiming for the establishment of SAR, five different… read more here.
Keywords: simplified analogues; activity; drug likeness; cruzi ... See more keywords
SwissADME: a free web tool to evaluate pharmacokinetics, drug-likeness and medicinal chemistry friendliness of small molecules
Sign Up to like & getrecommendations! Published in 2017 at "Scientific Reports"
DOI: 10.1038/srep42717
Abstract: To be effective as a drug, a potent molecule must reach its target in the body in sufficient concentration, and stay there in a bioactive form long enough for the expected biologic events to occur.… read more here.
Keywords: web tool; chemistry; pharmacokinetics drug; drug ... See more keywords
Anti-Candida attributes and in-silico drug-likeness properties of phenyl 2'β, 6'β-trimethyl cyclohexyl ketone and phenyl nonanyl ether produced by Streptomyces chrestomyceticus ADP4.
Sign Up to like & getrecommendations! Published in 2022 at "Journal of applied microbiology"
DOI: 10.1093/jambio/lxac024
Abstract: AIM To isolate and characterize anti-Candida compounds from soil actinobacterium Streptomyces chrestomyceticus ADP4 and to assess their drug likeness. METHODS AND RESULTS Two anti-Candida compounds, Phenyl 2'α, 2'β, 6'β-trimethyl cyclohexyl ketone (1PB1) and Phenyl nonanyl… read more here.
Keywords: drug likeness; anti candida; chrestomyceticus adp4; candida ... See more keywords
The drug likeness analysis of anti-inflammatory clerodane diterpenoids
Sign Up to like & getrecommendations! Published in 2020 at "Chinese Medicine"
DOI: 10.1186/s13020-020-00407-w
Abstract: Inflammation is an active defense response of the body against external stimuli. Long term low-grade inflammation has been considered as a deteriorated factor for aging, cancer, neurodegeneration and metabolic disorders. The clinically used glucocorticoids and… read more here.
Keywords: anti inflammatory; clerodane diterpenoids; inflammation; drug likeness ... See more keywords
Eco-friendly synthesis, characterization, and drug-likeness properties of new uracils and their biological evaluation
Sign Up to like & getrecommendations! Published in 2017 at "Green Processing and Synthesis"
DOI: 10.1515/gps-2016-0199
Abstract: Abstract Several pyridopyrimidine derivatives have been synthesized through different synthetic processes. The different physicochemical factors for their synthesis were also discussed. A comparison between the conventional and microwave-assisted synthesis was conducted by comparing total time… read more here.
Keywords: eco friendly; characterization drug; drug likeness; friendly synthesis ... See more keywords
Drug likeness, targets, molecular docking and ADMET studies for some indolizine derivatives.
Sign Up to like & getrecommendations! Published in 2018 at "Die Pharmazie"
DOI: 10.1691/ph.2018.8061
Abstract: The aim of this work was to investigate the biomolecular targets for a library of indolizines, study their molecular properties, drug likeness, target prediction, performing docking studies and exploring their ADMET profile in search for… read more here.
Keywords: likeness targets; docking admet; drug likeness; drug ... See more keywords
Multi-Targeted Molecular Docking, Pharmacokinetics, and Drug-Likeness Evaluation of Okra-Derived Ligand Abscisic Acid Targeting Signaling Proteins Involved in the Development of Diabetes
Sign Up to like & getrecommendations! Published in 2021 at "Molecules"
DOI: 10.3390/molecules26195957
Abstract: Diabetes mellitus is a global threat affecting millions of people of different age groups. In recent years, the development of naturally derived anti-diabetic agents has gained popularity. Okra is a common vegetable containing important bioactive… read more here.
Keywords: abscisic acid; okra; drug; molecular docking ... See more keywords