中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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CAS IR Grid
机构
上海药物研究所 [8]
采集方式
OAI收割 [8]
内容类型
期刊论文 [8]
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2022 [1]
2019 [1]
2018 [2]
2016 [1]
2015 [1]
2014 [1]
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专题:上海药物研究所
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Learning with uncertainty to accelerate the discovery of histone lysine-specific demethylase 1A (KDM1A/LSD1) inhibitors
期刊论文
OAI收割
BRIEFINGS IN BIOINFORMATICS, 2022, 页码: 14
作者:
Wang, Dong
;
Wu, Zhenxing
;
Shen, Chao
;
Bao, Lingjie
;
Luo, Hao
  |  
收藏
  |  
浏览/下载:26/0
  |  
提交时间:2023/04/10
uncertainty estimation
graph neural network
KDM1A
LSD1 inhibitors
upper confidence bound method
virtual screening
A Novel Allosteric Inhibitor of Phosphoglycerate Mutase 1 Suppresses Growth and Metastasis of Non-Small-Cell Lung Cancer
期刊论文
OAI收割
CELL METABOLISM, 2019, 卷号: 30, 期号: 6, 页码: 1107-+
作者:
Huang, Ke
;
Liang, Qian
;
Zhou, Ye
;
Jiang, Lu-lu
;
Gu, Wei-ming
  |  
收藏
  |  
浏览/下载:81/0
  |  
提交时间:2020/07/01
Identification of compound D2923 as a novel anti-tumor agent targeting CSF1R
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2018, 卷号: 39, 期号: 11, 页码: 1768-1776
作者:
Liu, Ying-Qiang
;
Wang, Ya-Nan
;
Lu, Xiao-Yun
;
Tong, Lin-Jiang
;
Li, Yan
  |  
收藏
  |  
浏览/下载:110/0
  |  
提交时间:2019/01/08
CSF-1R
small-molecule inhibitor
macrophage
myeloid leukemia
Rapid profiling of polymeric phenolic acids in Salvia miltiorrhiza by hybrid data-dependent/targeted multistage mass spectrometry acquisition based on expected compounds prediction and fragment ion searching
期刊论文
OAI收割
JOURNAL OF SEPARATION SCIENCE, 2018, 卷号: 41, 期号: 8, 页码: 1888-1895
作者:
Shen, Yao
;
Feng, Zijin
;
Yang, Min
;
Zhou, Zhe
;
Han, Sumei
  |  
收藏
  |  
浏览/下载:30/0
  |  
提交时间:2019/01/08
data dependent acquisition
expected compounds prediction
parent list
polymeric phenolic acids
traditional Chinese medicine
Design and discovery of new pyrimidine coupled nitrogen aromatic rings as chelating groups of JMJD3 inhibitors
期刊论文
OAI收割
BIOORGANIC & MEDICINAL CHEMISTRY LETTERS, 2016, 卷号: 26, 期号: 3, 页码: 721-725
作者:
Hu, Jianping
;
Wang, Xin
;
Chen, Lin
;
Huang, Min
;
Tang, Wei
  |  
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2019/01/08
Epigenetics
Histone demethylase
JMJD3 inhibitors
GSK-J1
Chelating group
Fragment-Based Drug Discovery of 2-Thiazolidinones as BRD4 Inhibitors: 2. Structure-Based Optimization
期刊论文
OAI收割
JOURNAL OF MEDICINAL CHEMISTRY, 2015, 卷号: 58, 期号: 3, 页码: 1281-1297
作者:
Zhao, Lele
;
Wang, Yingqing
;
Cao, Danyan
;
Chen, Tiantian
;
Wang, Qi
  |  
收藏
  |  
浏览/下载:18/0
  |  
提交时间:2019/01/08
Virtual screening and biological evaluation of novel small molecular inhibitors against protein arginine methyltransferase 1 (PRMT1)
期刊论文
OAI收割
ORGANIC & BIOMOLECULAR CHEMISTRY, 2014, 卷号: 12, 期号: 47, 页码: 9665-9673
作者:
Xie, Yiqian
;
Zhou, Ran
;
Lian, Fulin
;
Liu, Yan
;
Chen, Limin
  |  
收藏
  |  
浏览/下载:17/0
  |  
提交时间:2019/01/08
Energetic factors determining the binding of type I inhibitors to c-Met kinase: experimental studies and quantum mechanical calculations
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2013, 卷号: 34, 期号: 11, 页码: 1475-1483
作者:
Yu, Zhe
;
Ma, Yu-chi
;
Ai, Jing
;
Chen, Dan-qi
;
Zhao, Dong-mei
  |  
收藏
  |  
浏览/下载:16/0
  |  
提交时间:2019/01/08
receptor tyrosine kinase
type I c-Met inhibitor
cancer
quantum chemistry
protein-ligand interaction
symmetry-adapted perturbation theory (SAPT)