H. Yuan

发表

Structure-based and shape-complemented pharmacophore modeling for the discovery of novel checkpoint kinase 1 inhibitors

Ting Ran, Tao Lu, T. Ran, 2010, Journal of molecular modeling.

Synthesis and anti-inflammatory activity of saponin derivatives of δ-oleanolic acid.

Hongbin Sun, Haoliang Yuan, Xiaoan Wen, 2020, European journal of medicinal chemistry.

Discovery of Novel Nucleotide Prodrugs with Improved Potency Against HCV Variants Carrying NS5B S282T Mutation.

Guangji Wang, Hongbin Sun, Haoliang Yuan, 2017, Journal of medicinal chemistry.

Discovery of 4-((7H-Pyrrolo[2,3-d]pyrimidin-4-yl)amino)-N-(4-((4-methylpiperazin-1-yl)methyl)phenyl)-1H-pyrazole-3-carboxamide (FN-1501), an FLT3- and CDK-Kinase Inhibitor with Potentially High Efficiency against Acute Myelocytic Leukemia.

Shuai Lu, T. Lu, Yadong Chen, 2018, Journal of medicinal chemistry.

Divergent de novo synthesis of 2,4,5-trideoxyhexopyranosides derivatives of podophyllotoxin as anticancer agents.

Yu Zhao, Haoliang Yuan, Yapeng Lu, 2019, Future medicinal chemistry.

Inclusion of quinestrol and 2,6-di-O-methyl-β-cyclodextrin: Preparation, characterization, and inclusion mode.

Xiao‐Hui Liu, Qi Liu, Haoliang Yuan, 2013, Carbohydrate polymers.

3D-QSAR and molecular fragment replacement study on diaminopyrimidine and pyrrolotriazine ALK inhibitors

T. Ran, Haichun Liu, Yanmin Zhang, 2014 .

A SNP of bacterial blc disturbs gut lysophospholipid homeostasis and induces inflammation through epithelial barrier disruption

Di Chen, H. Sang, Zhaoyu Lin, 2020, EBioMedicine.

Structural insights into ligand binding features of dual FABP4/5 inhibitors by molecular dynamics simulations

Hongbin Sun, Haoliang Yuan, Chaoxin Wang, 2019, Journal of biomolecular structure & dynamics.

Novel Pt(ii) complexes with modified aroyl-hydrazone Schiff-base ligands: synthesis, cytotoxicity and action mechanism.

Zhenlei Zhang, Hong Liang, Feng Yang, 2019, Metallomics : integrated biometal science.

De novo design of quinazoline derivatives as CDK2 inhibitors: 3D-QSAR, molecular fragment replacement and Volsurf predictions

T. Ran, Haichun Liu, Shuai Lu, 2011 .

Discovery of a highly selective FLT3 inhibitor with specific proliferation inhibition against AML cells harboring FLT3-ITD mutation.

T. Ran, Haichun Liu, Shuai Lu, 2019, European journal of medicinal chemistry.

Developing a Novel Gold(III) Agent to Treat Glioma Based on the Unique Properties of Apoferritin Nanoparticles: Inducing Lethal Autophagy and Apoptosis.

Ming Jiang, Zhenlei Zhang, Hongbin Sun, 2020, Journal of medicinal chemistry.

Insight into the key features for ligand binding in Y1230 mutated c-Met kinase domain by molecular dynamics simulations

B. Xiang, Haichun Liu, Shuai Lu, 2018, Journal of biomolecular structure & dynamics.

Molecular Modeling of Exquisitely Selective c-Met Inhibitors through 3D-QSAR and Molecular Dynamics Simulations

Tao Lu, Huifang Li, Jinxing Xu, 2014, J. Chem. Inf. Model..

N-benzylpiperidinol derivatives as novel USP7 inhibitors: Structure-activity relationships and X-ray crystallographic studies.

Jun O. Liu, Hongbin Sun, Hui Chen, 2020, European journal of medicinal chemistry.

Molecular structure, IR spectra, and chemical reactivity of cisplatin and transplatin: DFT studies, basis set effect and solvent effect.

L. Qiu, Qingzhu Liu, Jianguo Lin, 2015, Spectrochimica acta. Part A, Molecular and biomolecular spectroscopy.

De novo design of PLK1 inhibitors based on 2-amino aromatic heterocyclic scaffold: 3D-QSAR and molecular fragment replacement

Haichun Liu, Shuai Lu, T. Lu, 2013 .

Identification of Novel Polo‐like Kinase 1 Inhibitors by a Hybrid Virtual Screening

Haichun Liu, Shuai Lu, T. Lu, 2012, Chemical biology & drug design.

Combined Pharmacophore Modeling, Docking, and 3D-QSAR Studies of PLK1 Inhibitors

Haichun Liu, Shuai Lu, T. Lu, 2011, International journal of molecular sciences.

Syntheses, Biological Evaluations, and Mechanistic Studies of Benzo[c][1,2,5]oxadiazole Derivatives as Potent PD-L1 Inhibitors with In Vivo Antitumor Activity.

Hongbin Sun, Shijun Wang, Pu Zhang, 2021, Journal of Medicinal Chemistry.

Discovery of Orally Bioavailable N-Benzylpiperidinol Derivatives as Potent and Selective USP7 Inhibitors with In Vivo Antitumor Immunity Activity against Colon Cancer.

Yuchen Gao, Hongbin Sun, Xiaoan Wen, 2022, Journal of medicinal chemistry.

A selectivity study of sodium‐dependent glucose cotransporter 2/sodium‐dependent glucose cotransporter 1 inhibitors by molecular modeling

T. Ran, Haichun Liu, Shuai Lu, 2015, Journal of molecular recognition : JMR.

Protein flexibility oriented virtual screening strategy for JAK2 inhibitors

T. Ran, Haichun Liu, Shuai Lu, 2015 .

Synthesis, biological evaluation and SAR studies of ursolic acid 3β-ester derivatives as novel CETP inhibitors.

Xiaoan Wen, Dongyin Chen, Fei Li, 2019, Bioorganic & medicinal chemistry letters.

Cytochrome P450 3A4 suppression by epimedium and active compound kaempferol leads to synergistic anti-inflammatory effect with corticosteroid

Xia Li, R. Tiwari, Xiufeng Yu, 2023, Frontiers in Pharmacology.

Design, Synthesis, and Biological Evaluation of Triazolone Derivatives as Potent PPARα/δ Dual Agonists for the Treatment of Nonalcoholic Steatohepatitis.

Jun Liu, Hongbin Sun, Gan Sun, 2022, Journal of medicinal chemistry.

Identification of structural properties influencing the metabolism of polycyclic aromatic hydrocarbons by cytochrome P450 1A1.

Liu Yang, Fei Huan, Chao Chen, 2020, The Science of the total environment.

In Silico Discovery of JMJD6 Inhibitors for Cancer Treatment.

T. Ran, T. Lu, Wen Liu, 2019, ACS medicinal chemistry letters.

Fragment-based strategy for structural optimization in combination with 3D-QSAR

Tao Lu, Shuai Lu, Yanmin Zhang, 2013, Journal of Computer-Aided Molecular Design.

Discovery of novel estrogen-related receptor α inverse agonists by virtual screening and biological evaluation

H Zhao, Xiaoan Wen, Kaiwen Hu, 2019, Journal of Biomolecular Structure and Dynamics.

Discovery of Novel Peroxisome Proliferator-Activated Receptor α (PPARα) Agonists by Virtual Screening and Biological Evaluation

Keguang Cheng, Xiaoan Wen, Liang Dai, 2020, J. Chem. Inf. Model..

Sulfonyl-containing phenyl-pyrrolyl pentane analogues: Novel non-secosteroidal vitamin D receptor modulators with favorable physicochemical properties, pharmacokinetic properties and anti-tumor activity.

Jun Du, Can Zhang, Anwei Zhou, 2018, European journal of medicinal chemistry.

Discovery of Novel Small Molecule Inhibitors Disrupting the PCSK9-LDLR Interaction

Liang Dai, Keguang Cheng, Hongbin Sun, 2021, J. Chem. Inf. Model..

Further Developments of the Phenyl-Pyrrolyl Pentane Series of Nonsteroidal Vitamin D Receptor Modulators as Anticancer Agents.

Bin Wang, Can Zhang, Haoliang Yuan, 2018, Journal of medicinal chemistry.

An Integrated Virtual Screening Approach for VEGFR-2 Inhibitors

Tao Lu, Shuai Lu, Yu Jiao, 2013, J. Chem. Inf. Model..

Synthesis of Functionalized Thiazolidin-2-imine and Oxazolidin-2-one Derivatives from p-Quinamines via [3 + 2] Annulation of Isothiocyanates and CO2.

Haoliang Yuan, Xiaoan Wen, Qinglong Xu, 2022, The Journal of organic chemistry.

Pharmacophore modeling and virtual screening studies to identify new c-Met inhibitors

Haichun Liu, Shuai Lu, T. Lu, 2012, Journal of Molecular Modeling.

Discovery of the First Subnanomolar PPARα/δ Dual Agonist for the Treatment of Cholestatic Liver Diseases.

Hongbin Sun, Gan Sun, Xin Liu, 2023, Journal of medicinal chemistry.

Discovery of novel AdipoRon analogues as potent anti-inflammatory agents against nonalcoholic steatohepatitis.

Haoliang Yuan, Xiangrui Xu, Zhiqi Feng, 2022, European journal of medicinal chemistry.

The STING antagonist H‐151 ameliorates psoriasis via suppression of STING/NF‐κB‐mediated inflammation

Jun O. Liu, Hongbin Sun, Xiaoan Wen, 2021, British journal of pharmacology.

Discovery of AdipoRon analogues as novel AMPK activators without inhibiting mitochondrial complex I.

Haoliang Yuan, M. Qian, Xiaoan Wen, 2020, European journal of medicinal chemistry.

USP7: Target Validation and Drug Discovery for Cancer Therapy.

Hongbin Sun, Haoliang Yuan, Xiaoan Wen, 2018, Medicinal chemistry (Shariqah (United Arab Emirates)).

Novel Strategy for Three-Dimensional Fragment-Based Lead Discovery

Jian Wang, Tao Lu, Weiwei Zhang, 2011, J. Chem. Inf. Model..

A selectivity study on mTOR/PI3Kα inhibitors by homology modeling and 3D-QSAR

T. Ran, Shulin Zhuang, Haichun Liu, 2011, Journal of Molecular Modeling.

Discovery of Ubiquitin-Specific Protease 7 (USP7) Inhibitors with Novel Scaffold Structures by Virtual Screening, Molecular Dynamics Simulation, and Biological Evaluation

Hongbin Sun, Wenfeng Zhao, Xiaoan Wen, 2020, J. Chem. Inf. Model..

A Selectivity Study of FFAR4/FFAR1 Agonists by Molecular Modeling

Hongbin Sun, Xiangying Zhang, Xiaoan Wen, 2019, J. Chem. Inf. Model..

Fragment-based discovery of novel pentacyclic triterpenoid derivatives as cholesteryl ester transfer protein inhibitors.

Hongbin Sun, Xiaoan Wen, Wenfeng Zhao, 2017, European journal of medicinal chemistry.

Design, synthesis and biological evaluation of β-carboline derivatives as novel inhibitors targeting B-Raf kinase.

Haichun Liu, T. Lu, Yadong Chen, 2012, Bioorganic & medicinal chemistry letters.

Discovery, optimization and biological evaluation for novel c-Met kinase inhibitors.

Yechun Xu, T. Lu, Yadong Chen, 2018, European journal of medicinal chemistry.

De novo design of N-(pyridin-4-ylmethyl)aniline derivatives as KDR inhibitors: 3D-QSAR, molecular fragment replacement, protein-ligand interaction fingerprint, and ADMET prediction

Haichun Liu, Shuai Lu, Yanmin Zhang, 2012, Molecular Diversity.

Discovery and Structural Optimization of Novel Quinolone Derivatives as Potent Irreversible Pan-Fibroblast Growth Factor Receptor Inhibitors for Treating Solid Tumors.

Qiaomei Jin, Libo Yan, Shihe Hu, 2023, Journal of medicinal chemistry.

Design, synthesis, and biological evaluation of (2E)-(2-oxo-1, 2-dihydro-3H-indol-3-ylidene)acetate derivatives as anti-proliferative agents through ROS-induced cell apoptosis.

Jun O. Liu, Hongbin Sun, Haoliang Yuan, 2016, European journal of medicinal chemistry.

An efficient multistep ligand-based virtual screening approach for GPR40 agonists

T. Ran, Haichun Liu, Shuai Lu, 2014, Molecular Diversity.

QSAR studies on imidazopyrazine derivatives as Aurora A kinase inhibitors

T. Lu, Y. Leng, H. Yuan, 2012, SAR and QSAR in environmental research.

De novo design of N-(pyridin-4-ylmethyl)aniline derivatives as KDR inhibitors: 3D-QSAR, molecular fragment replacement, protein-ligand interaction fingerprint, and ADMET prediction

Haichun Liu, Shuai Lu, Yanmin Zhang, 2012, Molecular Diversity.

Discovery of a Novel Macrocyclic ATP Citrate Lyase Inhibitor

Hongbin Sun, Xiaoan Wen, Liang Dai, 2022, J. Chem. Inf. Model..