Selective ligands of estrogen receptor β discovered using pharmacophore mapping and structure-based virtual screening

被引:0
|
作者
Lei Chen
Dang Wu
Han-ping Bian
Guang-lin Kuang
Jing Jiang
Wei-hua Li
Gui-xia Liu
Shi-en Zou
Jin Huang
Yun Tang
机构
[1] Shanghai Key Laboratory of New Drug Design,Department of Gynecology
[2] School of Pharmacy,undefined
[3] East China University of Science and Technology,undefined
[4] Obstetrics and Gynecology Hospital,undefined
[5] Fudan University,undefined
来源
关键词
estrogen receptor; subtype-selective ligand; estradiol; tamoxifen; pharmacophore mapping; structure-based virtual screening; breast cancer; anti-proliferation; cell cycle arrest;
D O I
暂无
中图分类号
学科分类号
摘要
引用
收藏
页码:1333 / 1341
页数:8
相关论文
共 50 条
  • [1] Selective ligands of estrogen receptor β discovered using pharmacophore mapping and structure-based virtual screening
    Chen, Lei
    Wu, Dang
    Bian, Han-ping
    Kuang, Guang-lin
    Jiang, Jing
    Li, Wei-hua
    Liu, Gui-xia
    Zou, Shi-en
    Huang, Jin
    Tang, Yun
    [J]. ACTA PHARMACOLOGICA SINICA, 2014, 35 (10) : 1333 - 1341
  • [2] Discovery of Potent Ligands for Estrogen Receptor β by Structure-Based Virtual Screening
    Shen, Jie
    Tan, Chengfang
    Zhang, Yanyan
    Li, Xi
    Li, Weihua
    Huang, Jin
    Shen, Xu
    Tang, Yun
    [J]. JOURNAL OF MEDICINAL CHEMISTRY, 2010, 53 (14) : 5361 - 5365
  • [3] Improved structure-based virtual screening of estrogen receptor alpha with data fusion of pharmacophore and docking methods
    Cagasova, Kristyna
    Josan, Jatinder
    [J]. ABSTRACTS OF PAPERS OF THE AMERICAN CHEMICAL SOCIETY, 2017, 254
  • [4] Discovery of Novel Biased Opioid Receptor Ligands through Structure-Based Pharmacophore Virtual Screening and Experiment
    Jeong, Pyeonghwa
    Kim, Soo-Kyung
    Li, Quanjie
    Oh, Su-jin
    Son, Seonil
    Chen, Guangju
    Tan, Hongwei
    Kim, Siwon
    Park, Jong-Hyun
    Park, Ki Duk
    Kim, Yeo Ok
    Yoon, Myung Ha
    Kim, Yong-Chul
    Goddard, William A., III
    [J]. CHEMMEDCHEM, 2019, 14 (20) : 1783 - 1794
  • [5] Estrogen receptor potentially stable conformations from molecular dynamics as a structure-based pharmacophore model for mapping, screening, and identifying ligands-a new paradigm shift in pharmacophore screening
    Shanmugarajan, Dhivya
    David, Charles
    [J]. JOURNAL OF BIOMOLECULAR STRUCTURE & DYNAMICS, 2023, 41 (11): : 4939 - 4948
  • [6] Structure-based design of estrogen receptor-β selective ligands
    Manas, ES
    Unwalla, RJ
    Xu, ZB
    Malamas, MS
    Miller, CP
    Harris, HA
    Hsiao, C
    Akopian, T
    Hum, WT
    Malakian, K
    Wolfrom, S
    Bapat, A
    Bhat, RA
    Stahl, ML
    Somers, WS
    Alvarez, JC
    [J]. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY, 2004, 126 (46) : 15106 - 15119
  • [7] Structure-based virtual screening for insect ecdysone receptor ligands using MM/PBSA
    Horoiwa, Shinri
    Yokoi, Taiyo
    Masumoto, Satoru
    Minami, Saki
    Ishizuka, Chiharu
    Kishikawa, Hidetoshi
    Ozaki, Shunsuke
    Kitsuda, Shigeki
    Nakagawa, Yoshiaki
    Miyagawa, Hisashi
    [J]. BIOORGANIC & MEDICINAL CHEMISTRY, 2019, 27 (06) : 1065 - 1075
  • [8] Discovery of natural estrogen receptor modulators with structure-based virtual screening
    Cao, Xianwen
    Jiang, Jing
    Zhang, Shoude
    Zhu, Lili
    Zou, Juan
    Diao, Yanyan
    Xiao, Weilie
    Shan, Lei
    Sun, Handong
    Zhang, Weidong
    Huang, Jin
    Li, Honglin
    [J]. BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2013, 23 (11) : 3329 - 3333
  • [9] New leads for DPP IV inhibition: structure-based pharmacophore mapping and virtual screening study
    Almasri, Ihab M.
    Taha, Mutasem O.
    Mohammad, Mohammad K.
    [J]. ARCHIVES OF PHARMACAL RESEARCH, 2013, 36 (11) : 1326 - 1337
  • [10] New leads for DPP IV inhibition: structure-based pharmacophore mapping and virtual screening study
    Ihab M. Almasri
    Mutasem O. Taha
    Mohammad K. Mohammad
    [J]. Archives of Pharmacal Research, 2013, 36 : 1326 - 1337