In silico ADMET, molecular docking and molecular simulation-based study of glabridin’s natural and semisynthetic derivatives as potential tyrosinase inhibitors

被引:0
|
作者
Arti Kumari
Rakesh kumar
Gira Sulabh
Pratishtha Singh
Jainendra Kumar
Vijay Kumar Singh
Krishna Kumar Ojha
机构
[1] Patna Women’s College,Department of Biotechnology
[2] Central University of South Bihar,Department of Bioinformatics
[3] Manipal TATA Medical College,Department of Pharmacology
[4] Manipal Academy of Higher Education,School of Life Sciences
[5] Jawaharlal Nehru University,undefined
[6] Patliputra University,undefined
来源
关键词
Hyperpigmentation; Melanogenesis; Tyrosinase; Glabridin; 5′-formylglabridin; Kojic acid; Molecular simulation; Docking; Melanoma; Skin whitening;
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
页码:733 / 751
页数:18
相关论文
共 50 条
  • [1] In silico ADMET, molecular docking and molecular simulation-based study of glabridin's natural and semisynthetic derivatives as potential tyrosinase inhibitors
    Kumari, Arti
    Kumar, Rakesh
    Sulabh, Gira
    Singh, Pratishtha
    Kumar, Jainendra
    Singh, Vijay Kumar
    Ojha, Krishna Kumar
    [J]. ADVANCES IN TRADITIONAL MEDICINE, 2023, 23 (03) : 733 - 751
  • [2] Natural based piperine derivatives as potent monoamine oxidase inhibitors: an in silico ADMET analysis and molecular docking studies
    Dhiman, Priyanka
    Malik, Neelam
    Khatkar, Anurag
    [J]. BMC CHEMISTRY, 2020, 14 (01)
  • [3] Natural based piperine derivatives as potent monoamine oxidase inhibitors: an in silico ADMET analysis and molecular docking studies
    Priyanka Dhiman
    Neelam Malik
    Anurag Khatkar
    [J]. BMC Chemistry, 14
  • [4] Identification of Natural Compounds of the Apple as Inhibitors against Cholinesterase for the Treatment of Alzheimer's Disease: An In Silico Molecular Docking Simulation and ADMET Study
    Jamal, Qazi Mohammad Sajid
    Khan, Mohammad Imran
    Alharbi, Ali H. H.
    Ahmad, Varish
    Yadav, Brijesh Singh
    [J]. NUTRIENTS, 2023, 15 (07)
  • [5] In silico identification of potential phytochemical inhibitors for mpox virus: molecular docking, MD simulation, and ADMET studies
    Ghate, Sudeep D.
    Pinto, Larina
    Alva, Shivakiran
    Srinivasa, Mahendra Gowdru
    Vangala, Rajani Kanth
    Naik, Prashantha
    Revanasiddappa, B. C.
    Rao, R. Shyama Prasad
    [J]. MOLECULAR DIVERSITY, 2024,
  • [6] Piperine derivatives as potential inhibitors of Survivin: An in silico molecular docking
    Sattarinezhad, Elham
    Bordbar, Abdol-Khalegh
    Fani, Najmeh
    [J]. COMPUTERS IN BIOLOGY AND MEDICINE, 2015, 63 : 219 - 227
  • [7] Synthesis, cytotoxicity assay, and molecular docking study of hydroxychalcone derivatives as potential tyrosinase inhibitors
    Aris Stiawan
    Eti Nurwening Sholikhah
    Yehezkiel Steven Kurniawan
    Yoga Priastomo
    Jumina
    [J]. Journal of Chinese Pharmaceutical Sciences, 2021, 30 (08) : 634 - 644
  • [8] Flavonoids as potential KRAS inhibitors: DFT, molecular docking, molecular dynamics simulation and ADMET analyses
    Prinsa
    Saha, Supriyo
    Bulbul, Md Zahidul Haque
    Ozeki, Yasuhiro
    Alamri, Mubarak A.
    Kawsar, Sarkar M. A.
    [J]. JOURNAL OF ASIAN NATURAL PRODUCTS RESEARCH, 2024, 26 (08) : 955 - 992
  • [9] Molecular Docking and In Silico ADMET Study Reveals Flavonoids as a Potential Inhibitor of Aromatase
    Shah, Umang
    Patel, Samir
    Patel, Mehul
    Upadhayay, Jagat
    [J]. LETTERS IN DRUG DESIGN & DISCOVERY, 2017, 14 (11) : 1267 - 1276
  • [10] Discovery of Potential Natural STAT3 Inhibitors: An in silico Molecular Docking and Molecular Dynamics Study
    Gul, Sameena
    Muhammad, Shabbir
    Irfan, Muhammad
    Belali, Tareg M.
    Chaudhry, Aijaz Rasool
    Khan, Muhammad
    [J]. JOURNAL OF COMPUTATIONAL BIOPHYSICS AND CHEMISTRY, 2024, 23 (02): : 189 - 205