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Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [6]
大连化学物理研究所 [2]
化学研究所 [1]
昆明植物研究所 [1]
过程工程研究所 [1]
昆明动物研究所 [1]
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OAI收割 [12]
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期刊论文 [12]
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2023 [1]
2019 [1]
2018 [1]
2011 [3]
2009 [1]
2008 [1]
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Discovery of orally effective and safe GPR40 agonists by incorporating a chiral, rigid and polar sulfoxide into 8-position to the carboxylic acid
期刊论文
OAI收割
EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY, 2023, 卷号: 251, 页码: 115267
作者:
Chen, Cheng
;
Guo, Shi-Meng
;
Sun, Yuanjun
;
Li, He
;
Hu, Nan
  |  
收藏
  |  
浏览/下载:1/0
  |  
提交时间:2024/03/27
GPR40
Glucose-stimulated insulin secretion
Type 2 diabetes mellitus
Lipophilicity
Liver safety
Three-in-one pharmacophore
2-(phenylsulfinyl)acetic acid
Discovery of novel indoleamine 2,3-dioxygenase 1 (IDO1) inhibitors by virtual screening
期刊论文
OAI收割
COMPUTATIONAL BIOLOGY AND CHEMISTRY, 2019, 卷号: 78, 页码: 306-316
作者:
Zhou, Yeheng
;
Peng, Jiale
;
Li, Penghua
;
Du, Haibo
;
Li, Yaping
  |  
收藏
  |  
浏览/下载:57/0
  |  
提交时间:2019/03/25
IDO1
Molecular docking
HipHop pharmacophore
3D-QSAR
PAINS
Identification of a novel selective small-molecule inhibitor of protein arginine methyltransferase 5 (PRMT5) by virtual screening, resynthesis and biological evaluations
期刊论文
OAI收割
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2018, 卷号: 28, 期号: 9, 页码: 1476-1483
作者:
Zhu, Kongkai
;
Jiang, Chengshi
;
Tao, Hongrui
;
Liu, Jingqiu
;
Zhang, Hua
  |  
收藏
  |  
浏览/下载:59/0
  |  
提交时间:2019/01/08
PRMT5 inhibitor
Resynthesis
Virtual screening
Molecular docking
Molecular dynamics simulation
Investigation on Quantitative Structure Activity Relationships and Pharmacophore Modeling of a Series of mGluR2 Antagonists
期刊论文
OAI收割
international journal of molecular sciences, 2011, 卷号: 12, 期号: 9, 页码: 5999-6023
作者:
Zhang, Meng-Qi
;
Zhang, Xiao-Le
;
Li, Yan
;
Fan, Wen-Jia
;
Wang, Yong-Hua
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2015/11/12
3D-QSAR
mGluR2 antagonist
CoMFA
CoMSIA
pharmacophore modeling
Mangiferin, an Anti-HIV-1 Agent Targeting Protease and Effective against Resistant Strains
期刊论文
OAI收割
MOLECULES, 2011, 卷号: 16, 期号: 5, 页码: 4264-4277
作者:
Wang, Rui-Rui
;
Gao, Yue-Dong
;
Ma, Chun-Hui
;
Zhang, Xing-Jie
;
Huang, Cheng-Gang
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2019/01/08
mangiferin
HIV-1
protease
anti-HIV agents
drug resistance
Mangiferin, an Anti-HIV-1 Agent Targeting Protease and Effective against Resistant Strains
期刊论文
OAI收割
MOLECULES, 2011, 卷号: 16, 期号: 5, 页码: 4264-4277
作者:
Wang RR
;
Gao YD
;
Ma CH
;
Zhang XJ
;
Huang CG[*]
收藏
  |  
浏览/下载:14/0
  |  
提交时间:2011/06/13
mangiferin
HIV-1
protease
anti-HIV agents
drug resistance
Pharmacophore-based virtual screening versus docking-based virtual screening: a benchmark comparison against eight targets
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2009, 卷号: 30, 期号: 12, 页码: 1694-1708
作者:
Chen, Zhi
;
Li, Hong-lin
;
Zhang, Qi-jun
;
Bao, Xiao-guang
;
Yu, Kun-qian
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2019/01/08
pharmacophore
docking
LigandScout
enrichment
hit rate
Discovery of Multitarget Inhibitors by Combining Molecular Docking with Common Pharmacophore Matching
期刊论文
OAI收割
JOURNAL OF MEDICINAL CHEMISTRY, 2008, 卷号: 51, 期号: 24, 页码: 7882-7888
作者:
Wei, Dengguo
;
Jiang, Xiaolu
;
Zhou, Lu
;
Chen, Jing
;
Chen, Zheng
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2019/04/09
Flavonoids with aldose reductase inhibiting activity: Pharmacophore modeling and implications for mechanism
期刊论文
OAI收割
ACTA PHYSICO-CHIMICA SINICA, 2007, 卷号: 23, 期号: 7, 页码: 1059-1064
作者:
Liu Hai-Bo
;
Wang Zhan-Li
;
Qiao Ying-Xin
;
Zhou Jia-Ju
收藏
  |  
浏览/下载:9/0
  |  
提交时间:2013/10/15
aldose reductase inhibitor
flavonoids
pharmacophore model
Farnesyltransferase pharmacophore model derived from diverse classes of inhibitors
期刊论文
OAI收割
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2007, 卷号: 17, 期号: 1, 页码: 243-249
作者:
Lu, Aijun
;
Zhang, Jian
;
Yin, Xiaojin
;
Luo, Xiaomin
;
Jiang, Hualiang
  |  
收藏
  |  
浏览/下载:11/0
  |  
提交时间:2019/01/08
farnesyltransferase
inhibitor
anticancer
pharmacophore model
QSAR