Results 31 to 40 of about 1,944,029 (193)

DrugMetric: quantitative drug-likeness scoring based on chemical space distance. [PDF]

Brief Bioinform
Li B, Wang Z, Liu Z, Tao Y, Sha C, He M, Li X.   +6 more
europepmc   +2 more sources

Isoliensinine: A Natural Compound with “Drug-Like” Potential [PDF]

Frontiers in Pharmacology, 2021
Isoliensinine, a bisbenzylisoquinoline alkaloid isolated from Nelumbo nucifera Gaertn, exerts a variety of beneficial effects, such as antitumor, cardioprotective, antioxidant, antidepressant, and anti-HIV effects, and ameliorates T2DM with hyperlipidemia and Alzheimer’s disease.
Yan Cheng, Yan Cheng, Hong-Li Li, Zi-Wei Zhou, Zi-Wei Zhou, Hui-Zhi Long, Hui-Zhi Long, Hong-Yu Luo, Hong-Yu Luo, Dan-Dan Wen, Lin Cheng, Li-Chen Gao, Li-Chen Gao   +12 more
openaire   +3 more sources

Drug likeness and medicinal chemistry predictions.

, 2023
Drug likeness and medicinal chemistry predictions.
Marcus Tullius Scotti (7483265), Amanda Bruno da Silva Bellini Ramos (16510568), Marcos José Marques (7825973), Renata Priscila Barros de Menezes (13034106), Bruna Ramos dos Santos (16510565), Juliana Quero Reimão (16510574), Fábio Antônio Colombo (16510571)   +6 more
core   +1 more source

Quantitative estimate of protein-protein interaction targeting drug-likeness [PDF]

, 2021
The quantification of drug-likeness is very useful for screening drug candidates. The quantitative estimate of drug-likeness (QED) is the most commonly used quantitative drug efficacy assessment method proposed by Bickerton et al.
Takatsugu, Kosugi, Masahito, Ohue
core   +1 more source

Recent advance in treatment of osteoarthritis by bioactive components from herbal medicine

Chinese Medicine, 2020
Osteoarthritis (OA) is a common chronic articular degenerative disease, and characterized by articular cartilage degradation, synovial inflammation/immunity, and subchondral bone lesion, etc.
Xu-zhao Li, Shuai-nan Zhang
doaj   +1 more source

Developing a Drug-like Natural Product Library [PDF]

Journal of Natural Products, 2008
Addressing drug-like/lead-like properties of biologically active small molecules early in a lead generation program is the current paradigm within the drug discovery community. Lipinski's "rule of five" has become the most commonly used tool to assess the relationship between structures and drug-like properties.
Quinn, Ronald J, Carroll, Anthony R, Pham, Ngoc B, Baron, Paul, Palframan, Meredith E, Suraweera, Lekha, Pierens, Gregory K, Muresan, Sorel   +7 more
openaire   +5 more sources

Xanthones, A Promising Anti-Inflammatory Scaffold: Structure, Activity, and Drug Likeness Analysis

Molecules, 2020
Inflammation is the body’s self-protective response to multiple stimulus, from external harmful substances to internal danger signals released after trauma or cell dysfunction.
Zheling Feng, Xiuqiang Lu, Lishe Gan, Qingwen Zhang, Ligen Lin   +4 more
doaj   +1 more source

Molecular Docking and Drug-likeness Prediction of New Potent Tubulin Colchicine Binding Site Inhibitors for Potential Antitumor Drug

Cumhuriyet Science Journal, 2022
Cancer is a real public health problem that figures among the main causes of morbidity and mortality in the world. The Colchicine Binding Site (CBS) is an important pocket for potential tubulin polymerization destabilizers.
Soumıa Tenıou, Naamane Akakba, Amine Abdelazız, El Hassen Mokranı, Abderrahmane Benseguenı, Rym Gouta Demmak   +5 more
doaj   +1 more source

In Silico Analysis of 14-Deoxy 11, 12-Didehydro Andrographolide (AGP 2) from Sambiloto (Andrographis paniculata) as Drug Candidate Against SARS-CoV-2

Hayati Journal of Biosciences, 2023
The outbreak of the COVID-19 pandemic in the world has urged researchers to develop a vaccine or therapeutic drugs to fight this virus. This study aimed to assay 14 deoxy-11,12-didehydroandrographolide (AGP 2) ability as an inhibitor of 3-chymotrypsin ...
Muhammad Vicky Astria, Lud Waluyo, Roimil Latifa, Moh. Mirza Nuryadi, Rr. Eko Susetyarini, Mohd. Affendi Labo   +5 more
doaj   +1 more source

ADMET-informatics, Pharmacokinetics, Drug-likeness and Medicinal Chemistry of Bioactive Compounds of Physalis minima Ethanolic Leaf Extract (PMELE) as a Potential Source of Natural Lead Molecules for Next Generation Drug Design, Development and Therapies [PDF]

, 2022
Physalis minima (PM) belongs to the family Solanaceae. PM has been traditionally used to cure and prevent several disorders as documented in Vedic Texts. Nevertheless, scientific values of traditional claims haven\u27t been explored yet.
Priyanka, R., Loganathan, T., Pandiarajan, G., Sutha, S., Chandran, M., Abraham, GC., Jayakumararaj, R., Grace Lydial Pushpalatha, G, Ramya, S., Kaliraj, P.   +9 more
core   +1 more source