Xiaojun Yao

Publication Activity (10 Years)

Years Active: 2021-2024
Publications (10 Years): 28

Top Topics

Machine Learning

Squamous Cell Carcinoma

Top Venues

Journal of chemical information and modeling

Journal of medicinal chemistry

Organic letters

ACS central science

This page only lists publications with an associated author ORCID identifier.

Publications

Jing-Yun Zheng, Ying Luo, Ting-Ting Ou, Xin-Jie Zhang, Yong-Qiang Lao, Na Feng, Jin-Bao Peng, Xiang-Zhi Zhang, Xiaojun Yao, Ai-Jun Ma
Acid-Promoted Cyclization of α-Azidobenzyl Ketones through C═N Bond Formation: Synthesis of 6-Substituted Quinoline Derivatives. Organic letters 26 (3) (2024)
Shuo Liu, Jialiang Yu, Ningxi Ni, Zidong Wang, Mengyun Chen, Yuquan Li, Chen Xu, Yahao Ding, Jun Zhang, Xiaojun Yao, Huan-Xiang Liu
Versatile Framework for Drug-Target Interaction Prediction by Considering Domain-Specific Features. Journal of chemical information and modeling (2024)
Mingyang Wang, Zhengjian Wu, Jike Wang, Gaoqi Weng, Yu Kang, Peichen Pan, Dan Li, Yafeng Deng, Xiaojun Yao, Zhitong Bing, Chang-Yu Hsieh, Ting-Jun Hou
Genetic Algorithm-Based Receptor Ligand: A Genetic Algorithm-Guided Generative Model to Boost the Novelty and Drug-Likeness of Molecules in a Sampling Chemical Space. Journal of chemical information and modeling 64 (4) (2024)
Mingfei Wu, Yiquan Wu, Yuyuan Jin, Xinfei Mao, Shenxin Zeng, Hengyuan Yu, Jingyu Zhang, Yuheng Jin, Yizhe Wu, Tengfei Xu, Yong Chen, Yu-Wei Wang, Xiaojun Yao, Yong-Zhou Hu, Wenhai Huang, Xiao-Wu Dong
Discovery of an Exceptionally Orally Bioavailable and Potent HPK1 PROTAC with Enhancement of Antitumor Efficacy of Anti-PD-L1 Therapy. Journal of medicinal chemistry (2024)
Mingfei Wu, Yiquan Wu, Yuyuan Jin, Xinfei Mao, Shenxin Zeng, Hengyuan Yu, Jingyu Zhang, Yuheng Jin, Yizhe Wu, Tengfei Xu, Yong Chen, Yu-Wei Wang, Xiaojun Yao, Yong-Zhou Hu, Wenhai Huang, Xiao-Wu Dong
Discovery of an Exceptionally Orally Bioavailable and Potent HPK1 PROTAC with Enhancement of Antitumor Efficacy of Anti-PD-L1 Therapy. Journal of medicinal chemistry 67 (16) (2024)
Mingyang Wang, Zhengjian Wu, Jike Wang, Gaoqi Weng, Yu Kang, Peichen Pan, Dan Li, Yafeng Deng, Xiaojun Yao, Zhitong Bing, Chang-Yu Hsieh, Ting-Jun Hou
Genetic Algorithm-Based Receptor Ligand: A Genetic Algorithm-Guided Generative Model to Boost the Novelty and Drug-Likeness of Molecules in a Sampling Chemical Space. Journal of chemical information and modeling 64 (4) (2024)
Mingfei Wu, Yiquan Wu, Yuyuan Jin, Xinfei Mao, Shenxin Zeng, Hengyuan Yu, Jingyu Zhang, Yuheng Jin, Yizhe Wu, Tengfei Xu, Yong Chen, Yu-Wei Wang, Xiaojun Yao, Yong-Zhou Hu, Wenhai Huang, Xiao-Wu Dong
Discovery of an Exceptionally Orally Bioavailable and Potent HPK1 PROTAC with Enhancement of Antitumor Efficacy of Anti-PD-L1 Therapy. Journal of medicinal chemistry 67 (16) (2024)
Mingyang Wang, Zhengjian Wu, Jike Wang, Gaoqi Weng, Yu Kang, Peichen Pan, Dan Li, Yafeng Deng, Xiaojun Yao, Zhitong Bing, Chang-Yu Hsieh, Ting-Jun Hou
Genetic Algorithm-Based Receptor Ligand: A Genetic Algorithm-Guided Generative Model to Boost the Novelty and Drug-Likeness of Molecules in a Sampling Chemical Space. Journal of chemical information and modeling 64 (4) (2024)
Shuo Liu, Jialiang Yu, Ningxi Ni, Zidong Wang, Mengyun Chen, Yuquan Li, Chen Xu, Yahao Ding, Jun Zhang, Xiaojun Yao, Huan-Xiang Liu
Versatile Framework for Drug-Target Interaction Prediction by Considering Domain-Specific Features. Journal of chemical information and modeling 64 (14) (2024)
Mingyang Wang, Zhengjian Wu, Jike Wang, Gaoqi Weng, Yu Kang, Peichen Pan, Dan Li, Yafeng Deng, Xiaojun Yao, Zhitong Bing, Chang-Yu Hsieh, Ting-Jun Hou
Genetic Algorithm-Based Receptor Ligand: A Genetic Algorithm-Guided Generative Model to Boost the Novelty and Drug-Likeness of Molecules in a Sampling Chemical Space. Journal of chemical information and modeling (2024)
Jing-Yun Zheng, Ying Luo, Ting-Ting Ou, Xin-Jie Zhang, Yong-Qiang Lao, Na Feng, Jin-Bao Peng, Xiang-Zhi Zhang, Xiaojun Yao, Ai-Jun Ma
Acid-Promoted Cyclization of α-Azidobenzyl Ketones through C═N Bond Formation: Synthesis of 6-Substituted Quinoline Derivatives. Organic letters (2024)
Yuwei Yang, Chang-Yu Hsieh, Yu Kang, Ting-Jun Hou, Huanxiang Liu, Xiaojun Yao
Deep Generation Model Guided by the Docking Score for Active Molecular Design. Journal of chemical information and modeling 63 (10) (2023)
Tao Wang, Wentao Wang, Xin Jiang, Jiaxing Mao, Linlin Zhuo, Mingzhe Liu, Xiangzheng Fu, Xiaojun Yao
ML-NPI: Predicting Interactions between Noncoding RNA and Protein Based on Meta-Learning in a Large-Scale Dynamic Graph. Journal of chemical information and modeling (2023)
Weitao Fu, Hao Yang, Chenxian Hu, Jianing Liao, Zhou Gong, Minkui Zhang, Shuai Yang, Shangxiang Ye, Yixuan Lei, Rong Sheng, Zhiguo Zhang, Xiaojun Yao, Chun Tang, Dan Li, Ting-Jun Hou
Small-Molecule Inhibition of Androgen Receptor Dimerization as a Strategy against Prostate Cancer. ACS central science 9 (4) (2023)
Xiao-Dan Yin, Xiaorui Wang, Yuquan Li, Jike Wang, Yuwei Wang, Yafeng Deng, Ting-Jun Hou, Huanxiang Liu, Pei Luo, Xiaojun Yao
CODD-Pred: A Web Server for Efficient Target Identification and Bioactivity Prediction of Small Molecules. Journal of chemical information and modeling (2023)
Yaguo Gong, Wei Ding, Panpan Wang, Qibiao Wu, Xiaojun Yao, Qingxia Yang
Evaluating Machine Learning Methods of Analyzing Multiclass Metabolomics. Journal of chemical information and modeling (2023)
Rui Wang, Zhecheng Zhou, Xiaonan Wu, Xin Jiang, Linlin Zhuo, Mingzhe Liu, Hao Li, Xiangzheng Fu, Xiaojun Yao
An Effective Plant Small Secretory Peptide Recognition Model Based on Feature Correction Strategy. Journal of chemical information and modeling (2023)
Weitao Fu, Hao Yang, Chenxian Hu, Jianing Liao, Zhou Gong, Minkui Zhang, Shuai Yang, Shangxiang Ye, Yixuan Lei, Rong Sheng, Zhiguo Zhang, Xiaojun Yao, Chun Tang, Dan Li, Ting-Jun Hou
Small-Molecule Inhibition of Androgen Receptor Dimerization as a Strategy against Prostate Cancer. ACS central science 9 (4) (2023)
Yuwei Yang, Chang-Yu Hsieh, Yu Kang, Ting-Jun Hou, Huanxiang Liu, Xiaojun Yao
Deep Generation Model Guided by the Docking Score for Active Molecular Design. Journal of chemical information and modeling (2023)
Yuwei Yang, Chang-Yu Hsieh, Yu Kang, Ting-Jun Hou, Huanxiang Liu, Xiaojun Yao
Deep Generation Model Guided by the Docking Score for Active Molecular Design. Journal of chemical information and modeling 63 (10) (2023)
Tian Guan, Yu-Dong Shen, Zhuo Jiang, Jin Wang, Shiwei Zhang, Anastasios Koidis, Xiaojun Yao, Yiyong Yan, Hong-Tao Lei
Facile Fabrication of Highly Quantum Dot/AuNP-Loaded Tags for a Dual-Modal Colorimetric/Reversed Ratiometric Fluorescence Immunochromatographic Assay. Analytical chemistry 94 (39) (2022)
An Xiaoli, Niu Yuzhen, Yang Qiong, Lei Yang, Xiaojun Yao, Zhitong Bing
Investigating the Dynamic Binding Behavior of PMX53 Cooperating with Allosteric Antagonist NDT9513727 to C5a Anaphylatoxin Chemotactic Receptor 1 through Gaussian Accelerated Molecular Dynamics and Free-Energy Perturbation Simulations. ACS chemical neuroscience 13 (23) (2022)
Xiaolan Hu, Jian-Lin Wu, Wen Miao, Fei Long, Hudan Pan, Tao Peng, Xiaojun Yao, Na Li
Covalent Protein Modification: An Unignorable Factor for Bisphenol A-Induced Hepatotoxicity. Environmental science & technology 56 (13) (2022)
Jike Wang, Xiaorui Wang, Huiyong Sun, Mingyang Wang, Yundian Zeng, Dejun Jiang, Zhenxing Wu, Zeyi Liu, Ben Liao, Xiaojun Yao, Chang-Yu Hsieh, Dong-Sheng Cao, Xi Chen, Ting-Jun Hou
ChemistGA: A Chemical Synthesizable Accessible Molecular Generation Algorithm for Real-World Drug Discovery. Journal of medicinal chemistry 65 (18) (2022)
Xin Chai, Huiyong Sun, Wenfang Zhou, Changwei Chen, Luhu Shan, Yuhui Yang, Junzhao He, Jinping Pang, Liu Yang, Xinyue Wang, Sunliang Cui, Yaqin Fu, Xiaohong Xu, Lei Xu, Xiaojun Yao, Dan Li, Ting-Jun Hou
Discovery of N -(4-(Benzyloxy)-phenyl)-sulfonamide Derivatives as Novel Antagonists of the Human Androgen Receptor Targeting the Activation Function 2. Journal of medicinal chemistry 65 (3) (2022)
Mingyang Wang, Chang-Yu Hsieh, Jike Wang, Dong Wang, Gaoqi Weng, Chao Shen, Xiaojun Yao, Zhitong Bing, HongLin Li, Dong-Sheng Cao, Ting-Jun Hou
RELATION: A Deep Generative Model for Structure-Based De Novo Drug Design. Journal of medicinal chemistry 65 (13) (2022)
Tukang Peng, Xiaohui Wang, Zhijun Li, Lei Bi, Jiebing Gao, Min Yang, Yuwei Wang, Xiaojun Yao, Hong Shan, Hongjun Jin
Preclinical Evaluation of [64Cu]NOTA-CP01 as a PET Imaging Agent for Metastatic Esophageal Squamous Cell Carcinoma. Molecular pharmaceutics 18 (9) (2021)
Shuzhen Cheng, Yuwei Wang, Hui Chen, Hanxiong Liu, Lishu Wang, Maurizio Battino, Xiaojun Yao, Beiwei Zhu, Lingjun Li
Anticoagulant Dodecapeptide Suppresses Thrombosis In Vivo by Inhibiting the Thrombin Exosite-I Binding Site. Journal of agricultural and food chemistry 69 (37) (2021)