Isolation, characterization, in vitro anticancer activity, dft calculations, molecular docking, bioactivity score, drug-likeness and admet studies of eight phytoconstituents …

DA Abdelrheem, AA Rahman, KNM Elsayed… - Journal of molecular …, 2021 - Elsevier
Recently, macroalgae or seaweeds serve as a treasure of potential drugs for cancer therapy.
The present study investigated the cytotoxic activity of eight compounds isolated from the …

Cytotoxic activity, molecular docking, pharmacokinetic properties and quantum mechanics calculations of the brown macroalga Cystoseira trinodis compounds

SA Ahmed, AA Rahman, KNM Elsayed… - Journal of …, 2021 - Taylor & Francis
In this study, nine compounds were isolated, eight of them were isolated for the first time
from Cystoseira trinodis. The biological activity of the extract, fractions and pure compounds …

[PDF][PDF] Novel anticancerous compounds from Sargassum wightii: In silico and in vitro approaches to test the antiproliferative efficacy

SMFM Begum, S Priya, R Sundararajan… - Journal of Advanced …, 2017 - academia.edu
Non-small cell lung cancer (NSCLC) contributes to 80% of lung cancer death. The poor
survival rate is contributed by the uncontrolled proliferation, evasion of apoptosis, ubiquitous …

Phytochemical profiling, antibacterial, and antibiofilm activities of Sargassum sp.(brown algae) from the Red Sea: ADMET prediction and molecular docking analysis

M Alreshidi, R Badraoui, M Adnan, M Patel, A Alotaibi… - Algal Research, 2023 - Elsevier
Brown algae from the Red sea are a rich source of bioactive molecules with high biological
activities. The present work was aimed at studying the phytochemical composition of the …

Biological activity, quantitative structure–activity relationship analysis, and molecular docking of xanthone derivatives as anticancer drugs

I Miladiyah, J Jumina, SM Haryana… - Drug design …, 2018 - Taylor & Francis
Background Xanthone derivatives have a wide range of pharmacological activities, such as
those involving antibacterial, antiviral, antimalarial, anthelmintic, anti-inflammatory …

Cytotoxicity and molecular docking studies on phytosterols isolated from Polygonum hydropiper L

M Ayaz, A Sadiq, A Wadood, M Junaid, F Ullah… - Steroids, 2019 - Elsevier
Based on our previous studies on cytotoxic potentials of Polygonum hydropiper L, two
steroidal compounds beta-sitosterol and stigmasterol were isolated from the most active …

Density functional theory study and anti-cancer properties of shyshaq plant: In view point of nano biotechnology

MAA Zadeh, H Lari, L Kharghanian… - Journal of …, 2015 - ingentaconnect.com
In this research, Quantum-mechanical calculations were performed at the HF method with
the STO-3G, 6-31G, 6-31G*, 6-31G**, 6-31+ G** and 6-31++ G** basis sets and at the BLYP …

Bioactive potential analysis of brown seaweed Sargassum wightii using UV-VIS and FT-IR

R Rajeswari, K Jeyaprakash - Journal of Drug Delivery and …, 2019 - jddtonline.info
The current study was investigated to explore the biogenic molecules of Sargassum wightii
collected from the south east of Tamil Nadu, India. The biogenic molecules extracted from …

QSAR and docking studies on xanthone derivatives for anticancer activity targeting DNA topoisomerase IIα

S Alam, F Khan - Drug Design, Development and Therapy, 2014 - Taylor & Francis
Due to the high mortality rate in India, the identification of novel molecules is important in the
development of novel and potent anticancer drugs. Xanthones are natural constituents of …

Cytotoxic meroterpenoids from brown alga Stypopodium schimperi (Kützing) Verlaque & Boudouresque with comprehensive molecular docking & dynamics and …

Ö Demirkıran, E Erol, H Şenol, İM Kesdi… - Process …, 2024 - Elsevier
In this study, five known meroterpenoids sargaol (1), flabellinone (2), stypodiol (3),
atomarianone A (4), atomarianone B (5), and a known steroid fucosterol (6) were isolated …