中国科学院机构知识库网格
Chinese Academy of Sciences Institutional Repositories Grid
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上海药物研究所 [21]
长春应用化学研究所 [16]
西北高原生物研究所 [8]
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期刊论文 [92]
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AI-enhanced virtual screening approach to hit identification for GluN1/GluN3A NMDA receptor
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 12
作者:
Ji, Yue-shan
;
Zeng, Yue
;
Hu, Shao-fei
;
Li, Shu-wang
;
Zhang, Bei-chen
  |  
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2025/12/04
N
-methyl-
D
-aspartate receptors (NMDARs)
GluN1/GluN3A
virtual screening
shape screening
rapid overlay of chemical structures (ROCS)
bidirectional and auto-regressive transformers (BART)
Identification of small-molecule inhibitors for GluN1/GluN3A NMDA receptors via a multiscale CNN-based prediction model
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 9
作者:
Han, Li
;
Zeng, Yue
;
Qu, Zhi-yan
;
Fang, Sui
;
Wang, Hai-ying
  |  
收藏
  |  
浏览/下载:3/0
  |  
提交时间:2025/12/04
N-methyl-D-aspartate receptors
GluN1/GluN3A
drug-target binding affinity
convolutional neural networks
ImageDTA
virtual screening
Discovery of selective GluN1/GluN3A NMDA receptor inhibitors using integrated AI and physics-based approaches
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 10
作者:
Li, Shi-wei
;
Zeng, Yue
;
Wu, Sa-nan
;
Ma, Xin-yue
;
Xu, Chao
  |  
收藏
  |  
浏览/下载:6/0
  |  
提交时间:2025/09/09
N-methyl-D-aspartate receptors
GluN1/GluN3A
deep learning
molecular docking
virtual screening
binding site identification
Discovery of novel GluN1/GluN3A NMDA receptor inhibitors using a deep learning-based method
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 8
作者:
Wang, Shi-hang
;
Zeng, Yue
;
Yang, Hao
;
Tian, Si-yuan
;
Zhou, Yong-qi
  |  
收藏
  |  
浏览/下载:47/0
  |  
提交时间:2025/07/25
N
-methyl-
D
-aspartate receptors
GluN1/GluN3A
ligand-based virtual screening
scaffold hopping
deep learning
GeminiMol
Dehydrotrametenolic acid methyl ester, a triterpenoid of
Poria cocos
, alleviates non-alcoholic steatohepatitis by suppressing NLRP3 inflammasome activation via targeting Caspase-1 in mice
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 17
作者:
Xia, Ling-yan
;
Yu, Nai-rong
;
Huang, Su-ling
;
Qu, Hui
;
Qin, Li
  |  
收藏
  |  
浏览/下载:44/0
  |  
提交时间:2025/06/23
non-alcoholic steatohepatitis
dehydrotrametenolic acid methyl ester
NLRP3 inflammasome
caspase-1
macrophage-hepatocyte/HSC crosstalk
An efficient deep learning-based strategy to screen inhibitors for GluN1/GluN3A receptor
期刊论文
OAI收割
ACTA PHARMACOLOGICA SINICA, 2025, 页码: 9
作者:
Wang, Ze-chen
;
Zeng, Yue
;
Sun, Jin-yuan
;
Chen, Xue-qin
;
Wu, Hao-chen
  |  
收藏
  |  
浏览/下载:44/0
  |  
提交时间:2025/04/24
deep learning
scoring function
GluN1/GluN3A receptor
N
-methyl-
D
-aspartate (NMDA) receptor
virtual screening
drug discovery
Precolumn derivatization LC-MS/MS method to simultaneous quantitation of 10 monosaccharides in rat plasma
期刊论文
OAI收割
JOURNAL OF PHARMACEUTICAL AND BIOMEDICAL ANALYSIS, 2023, 卷号: 234, 页码: 10
作者:
Li, Mengxue
;
Li, Ping
;
Ji, Yuting
;
Tian, Yihua
;
Zeng, Huiying
  |  
收藏
  |  
浏览/下载:101/0
  |  
提交时间:2023/10/17
LC-MS
MS
Monosaccharides
Derivatization
1-Phenyl-3-methyl-5-pyrazolone (PMP)
Biomarker
Engineering Corynebacterium glutamicum Mutants for 3-Methyl-1-butanol Production
期刊论文
OAI收割
BIOCHEMICAL GENETICS, 2019, 卷号: 57, 期号: 3, 页码: 443-454
作者:
Zhang, Yu
;
Zhang, Xiaohuan
;
Xiao, Shiyuan
;
Qi, Wei
;
Xu, Jingliang
  |  
收藏
  |  
浏览/下载:53/0
  |  
提交时间:2020/10/29
3-Methyl-1-butanol
L-Leucine
Corynebacterium glutanicum
Mutation breeding
Non-fermentation pathway
Vesicular glutamate transporter 1 (VGLUT1)-mediated glutamate release and membrane GluA1 activation is involved in the rapid antidepressant-like effects of scopolamine in mice
期刊论文
OAI收割
NEUROPHARMACOLOGY, 2018, 卷号: 131, 页码: 209-222
作者:
Yu, Hanjie
;
Li, Mengmeng
;
Zhou, Dongsheng
;
Lv, Dan
;
Liao, Qi
  |  
收藏
  |  
浏览/下载:111/0
  |  
提交时间:2019/01/08
Scopolamine
alpha-Amino-3-1-lydroxy-5-methyl-4-isoxazolepropionic acid receptor (AMPAR)
Vesicular glutamate transporter 1 (VGLUT1)
Brain-derived neurotrophic factor (BDNF)
VGF (non-acronymic)
Bicaudal C homolog 1 gene (BICC1)
Vesicular glutamate transporter 1 (VGLUT1)-mediated glutamate release and membrane GluA1 activation is involved in the rapid antidepressant-like effects of scopolamine in mice
期刊论文
OAI收割
Neuropharmacology, 2018, 期号: 131, 页码: 209-222
作者:
Qi Liao
;
Zhen Wang
;
Dan Lv
;
Dongsheng Zhou
;
Mengmeng Li
  |  
收藏
  |  
浏览/下载:97/0
  |  
提交时间:2018/09/28
Scopolamine
a -amino-3-hydroxy-5-methyl-4-
Isoxazolepropionic Acid Receptor (Ampar)
Vesicular Glutamate Transporter 1 (Vglut1)
Brain-derived Neurotrophic Factor (Bdnf)
Vgf (Non-acronymic)
Bicaudal c Homolog 1 Gene (Bicc1)