Jin Huang

发表

SHAFTS: a hybrid approach for 3D molecular similarity calculation. 2. Prospective case study in the discovery of diverse p90 ribosomal S6 protein kinase 2 inhibitors to suppress cell migration.

Hualiang Jiang, Xu Shen, Honglin Li, 2011, Journal of medicinal chemistry.

A genome-wide positioning systems network algorithm for in silico drug repurposing

M. Vidal, D. Hill, F. Cheng, 2019, Nature Communications.

Fast and effective identification of the bioactive compounds and their targets from medicinal plants via computational chemical biology approach

Honglin Li, Xiaofeng Liu, Weiqiang Lu, 2011 .

Natural products as a gold mine for selective matrix metalloproteinases inhibitors.

Honglin Li, Jin Huang, Weidong Zhang, 2012, Bioorganic & medicinal chemistry.

Discovery of non-peptide inhibitors of Plasmepsin II by structure-based virtual screening.

Honglin Li, Xiaofeng Liu, Jin Huang, 2013, Bioorganic & medicinal chemistry letters.

Identification of old drugs as potential inhibitors of HIV-1 integrase – human LEDGF/p75 interaction via molecular docking

Guixia Liu, Yun Tang, Weiqiang Lu, 2012, Journal of Molecular Modeling.

A protein-fragment complementation assay reveals that celastrol and gambogic acid suppress ERα mutants in breast cancer.

Weiqiang Lu, Jin Huang, Ting Gong, 2021, Biochemical pharmacology.

Comprehensive characterization of protein-protein interaction network perturbations by human disease mutations

E. Antman, M. Vidal, D. Hill, 2020, bioRxiv.

2-(3,4-Dihydro-4-Oxothieno[2,3-d]pyrimidin-2-ylthio) Acetamides as a New Class of Falcipain-2 Inhibitors. 3. Design, Synthesis and Biological Evaluation

Hualiang Jiang, Honglin Li, Weiqiang Lu, 2009, Molecules.

Synthesis and biological evaluation of novel 1,2,3-benzotriazin-4-one derivatives as leukotriene A4 hydrolase aminopeptidase inhibitors

Jin Huang, Xiaoyong Xu, Gaolei Wang, 2017 .

The efficient expression of human fibroblast collagenase in Escherichia coli and the discovery of flavonoid inhibitors

Weiqiang Lu, Jin Huang, Junsheng Zhu, 2013, Journal of enzyme inhibition and medicinal chemistry.

Coptisine, a natural alkaloid from Coptidis Rhizoma, inhibits plasmodium falciparum dihydroorotate dehydrogenase

Weiqiang Lu, Jin Huang, Qian Hu, 2018, Chemical biology & drug design.

Design and synthesis of small molecular dual inhibitor of falcipain-2 and dihydrofolate reductase as antimalarial agent.

Hualiang Jiang, Xu Shen, Honglin Li, 2012, Bioorganic & medicinal chemistry letters.

Bufexamac ameliorates LPS-induced acute lung injury in mice by targeting LTA4H

Weiqiang Lu, Jin Huang, Q. Xiao, 2016, Scientific Reports.

Peptidomimetic nitriles as selective inhibitors for the malarial cysteine protease falcipain-2

F. Diederich, Jin Huang, T. Schirmeister, 2011 .

A highly selective space-folded photo-induced electron transfer fluorescent probe for carbonic anhydrase isozymes IX and its applications for biological imaging.

Honglin Li, Weiqiang Lu, Yufang Xu, 2011, Chemical communications.

Substituted indolin-2-ones as p90 ribosomal S6 protein kinase 2 (RSK2) inhibitors: Molecular docking simulation and structure-activity relationship analysis.

Honglin Li, Xiaofeng Liu, Mengzhu Xue, 2013, Bioorganic & medicinal chemistry.

Optimization of heterocyclic substituted benzenesulfonamides as novel carbonic anhydrase IX inhibitors and their structure activity relationship.

Honglin Li, Zhenjiang Zhao, Yufang Xu, 2013, European journal of medicinal chemistry.

Caffeic acid phenethyl ester (CAPE), an active component of propolis, inhibits Helicobacter pylori peptide deformylase activity.

Weiqiang Lu, Jin Huang, Xu Shen, 2013, Biochemical and biophysical research communications.

Moracin C, A Phenolic Compound Isolated from Artocarpus heterophyllus, Suppresses Lipopolysaccharide-Activated Inflammatory Responses in Murine Raw264.7 Macrophages

Weiqiang Lu, Jin Huang, P. Ouyang, 2016, International journal of molecular sciences.

Discovery of new antimalarial agents: Second-generation dual inhibitors against FP-2 and PfDHFR via fragments assembely.

Hualiang Jiang, Yun Tang, Jin Huang, 2017, Bioorganic & medicinal chemistry.

Design, synthesis and biological evaluation of 3-piperazinecarboxylate sarsasapogenin derivatives as potential multifunctional anti-Alzheimer agents.

Jin Huang, Shiliang Li, Yan Wu, 2018, European journal of medicinal chemistry.

Synthesis, activity evaluation, and docking analysis of barbituric acid aryl hydrazone derivatives as RSK2 inhibitors

Honglin Li, Xiaofeng Liu, Weiqiang Lu, 2013, Journal of enzyme inhibition and medicinal chemistry.

Synthesis and biological evaluation of pentanedioic acid derivatives as farnesyltransferase inhibitors

Honglin Li, Zhenjiang Zhao, Yufang Xu, 2015 .

Drug Repurposing of Histone Deacetylase Inhibitors That Alleviate Neutrophilic Inflammation in Acute Lung Injury and Idiopathic Pulmonary Fibrosis via Inhibiting Leukotriene A4 Hydrolase and Blocking LTB4 Biosynthesis.

F. Cheng, Yun Tang, Mingyao Liu, 2017, Journal of medicinal chemistry.

Design and Synthesis of Osthole-based Compounds as Potential Nrf2 Agonists.

Jiayan, Jin Huang, Cui, 2022, Bioorganic & medicinal chemistry letters.

New tricks for human farnesyltransferase inhibitor: cancer and beyond.

Jin Huang, Jingyuan Wang, Xue Yao, 2017, MedChemComm.

1-(2,6-Dibenzyloxybenzoyl)-3-(9H-fluoren-9-yl)-urea: a novel cyclophilin A allosteric activator.

Hualiang Jiang, Ting Shi, Xu Shen, 2012, Biochemical and biophysical research communications.

Drug repurposing of ilepcimide that ameliorates experimental autoimmune encephalomyelitis via restricting inflammatory response and oxidative stress.

Weiqiang Lu, Jin Huang, Xi Liu, 2022, Toxicology and applied pharmacology.

Discovery of Natural Products as Novel and Potent FXR Antagonists by Virtual Screening

Honglin Li, Weidong Zhang, Jin Huang, 2018, Front. Chem..

Discovery of natural estrogen receptor modulators with structure-based virtual screening.

Honglin Li, Weidong Zhang, Xianwen Cao, 2013, Bioorganic & medicinal chemistry letters.

Discovery of Novel Small Molecule Anti-HCV Agents via the CypA Inhibitory Mechanism Using O-Acylation-Directed Lead Optimization

Hualiang Jiang, Jin Huang, Lei Liu, 2015, Molecules.

Novel benzoyl thioureido benzene sulfonamides as highly potent and selective inhibitors of carbonic anhydrase IX: optimization and bioactive studies.

Honglin Li, Li Liu, Zhenjiang Zhao, 2018, MedChemComm.

Natural Product Piperine Alleviates Experimental Allergic Encephalomyelitis in Mice by Targeting Dihydroorotate Dehydrogenase.

Yechun Xu, Weiqiang Lu, Jin Huang, 2020, Biochemical pharmacology.

Novel selective and potent inhibitors of malaria parasite dihydroorotate dehydrogenase: discovery and optimization of dihydrothiophenone derivatives.

Honglin Li, Zhenjiang Zhao, Yufang Xu, 2013, Journal of medicinal chemistry.

Total synthesis of the 2-arylbenzo[b]furan-containing natural products from Artocarpus

Weiqiang Lu, Jin Huang, Jian Li, 2015 .

Identification of novel falcipain-2 inhibitors as potential antimalarial agents through structure-based virtual screening.

Honglin Li, Jin Huang, Jin Zhu, 2009, Journal of medicinal chemistry.

Synthesis and Antimalarial Activity of Novel Dihydro-Artemisinin Derivatives

Weiqiang Lu, Jin Huang, Jian Wang, 2011, Molecules.

Triazole and Benzotriazole Derivatives as Novel Inhibitors for p90 Ribosomal S6 Protein Kinase 2: Synthesis, Molecular Docking and SAR Analysis

Honglin Li, Zhenjiang Zhao, Yufang Xu, 2013 .

Discovery of inhibitors to block interactions of HIV-1 integrase with human LEDGF/p75 via structure-based virtual screening and bioassays.

Weihua Li, Jin Huang, Lei Ma, 2012, Journal of medicinal chemistry.

Discovery of novel inhibitors for human farnesyltransferase (hFTase) via structure-based virtual screening

Honglin Li, Xiaofeng Liu, Zhenjiang Zhao, 2013 .

Myricetin is a novel inhibitor of human inosine 5'-monophosphate dehydrogenase with anti-leukemia activity.

Weiqiang Lu, Jin Huang, Qian Hu, 2016, Biochemical and biophysical research communications.

Target identification among known drugs by deep learning from heterogeneous networks

Xiangxiang Zeng, Ruth Nussinov, Feixiong Cheng, 2020, Chemical science.

Targeting Pyrimidine Metabolism in the Era of Precision Cancer Medicine

Weiqiang Lu, Jin Huang, Hui Ma, 2021, Frontiers in Oncology.

Prediction of Drug-Target Interactions and Drug Repositioning via Network-Based Inference

Chuang Liu, Jin Huang, Feixiong Cheng, 2012, PLoS Comput. Biol..

Identification, synthesis and pharmacological evaluation of novel anti-EV71 agents via cyclophilin A inhibition.

Hualiang Jiang, Jin Huang, Lei Liu, 2015, Bioorganic & medicinal chemistry letters.

FXR antagonism of NSAIDs contributes to drug-induced liver injury identified by systems pharmacology approach

Feixiong Cheng, Jin Huang, Weiqiang Lu, 2015, Scientific Reports.

Discovering potent small molecule inhibitors of cyclophilin A using de novo drug design approach.

Luhua Lai, Jianfeng Pei, Jin Huang, 2009, Journal of medicinal chemistry.

MAD2-p31comet axis deficiency reduces cell proliferation, migration and sensitivity of microtubule-interfering agents in glioma.

Jin Huang, Jing Zheng, Dang Wu, 2018, Biochemical and biophysical research communications.

Discovery of new potent inhibitors for carbonic anhydrase IX by structure-based virtual screening.

Chunmei Yang, Honglin Li, Lili Zhu, 2013, Bioorganic & medicinal chemistry letters.

Synthesis, Structure–Activity Relationship, and Pharmacophore Modeling Studies of Pyrazole‐3‐Carbohydrazone Derivatives as Dipeptidyl Peptidase IV Inhibitors

Hualiang Jiang, Guixia Liu, Yun Tang, 2012, Chemical biology & drug design.

Identification of diverse dipeptidyl peptidase IV inhibitors via structure-based virtual screening

Guixia Liu, Yun Tang, Wen Xiao, 2012, Journal of Molecular Modeling.

Synthesis of derivatives of methyl rosmarinate and their inhibitory activities against matrix metalloproteinase-1 (MMP-1).

Honglin Li, Weidong Zhang, Weiqiang Lu, 2013, European journal of medicinal chemistry.

Comprehensive characterization of protein–protein interactions perturbed by disease mutations

E. Antman, M. Vidal, F. Cheng, 2021, Nature Genetics.

Development of a new colorimetric assay for lipoxygenase activity.

Weiqiang Lu, Jin Huang, Xu Shen, 2013, Analytical biochemistry.

Shikonin is a novel and selective IMPDH2 inhibitor that target triple‐negative breast cancer

Weiqiang Lu, Jin Huang, Shuyi Wang, 2020, Phytotherapy research : PTR.

7-Chloroarctinone-b as a new selective PPARγ antagonist potently blocks adipocyte differentiation

Hualiang Jiang, Xu Shen, Jin Huang, 2009, Acta Pharmacologica Sinica.

Design, synthesis and inhibitory activity against human dihydroorotate dehydrogenase (hDHODH) of 1,3-benzoazole derivatives bearing amide units.

Jin Huang, Zhong Li, X. Shao, 2016, Bioorganic & medicinal chemistry letters.

Discovery of Orally Available Retinoic Acid Receptor-Related Orphan Receptor γ-t/Dihydroorotate Dehydrogenase Dual Inhibitors for the Treatment of Refractory Inflammatory Bowel Disease.

Yonghui Wang, Weiqiang Lu, Jin Huang, 2021, Journal of medicinal chemistry.

HL005—A new selective PPARγ antagonist specifically inhibits the proliferation of MCF-7

Xu Shen, Honglin Li, Hualiang Jiang, 2011, The Journal of Steroid Biochemistry and Molecular Biology.

In silico prediction of chemical mechanism of action via an improved network‐based inference method

Jie Li, Feixiong Cheng, Zengrui Wu, 2016, British journal of pharmacology.

Tables of Links TARGETS Nuclear hormone receptors a GPCRs b Estrogen receptor α HTR 1 A PPARG HTR 1 D RARB Enzymes c RXRA CA 1 Dipeptidyl peptidase IV LIGANDS Clomipramine Dapagliflozin Metformin Pioglitazone Promethazine Rosiglitazone Tamoxifen

F. Cheng, Weihua Li, Zengrui Wu, 2016 .

Novel dual inhibitors against FP-2 and PfDHFR as potential antimalarial agents: Design, synthesis and biological evaluation

Hualiang Jiang, Yun Tang, Jin Huang, 2017, Chinese Chemical Letters.

Identification of diverse natural products as falcipain-2 inhibitors through structure-based virtual screening.

Honglin Li, Xiaofeng Liu, Weidong Zhang, 2014, Bioorganic & medicinal chemistry letters.

Dietary flavonoids fisetin and myricetin: dual inhibitors of Plasmodium falciparum falcipain-2 and plasmepsin II.

Weiqiang Lu, Jin Huang, Huangtao Jin, 2014, Fitoterapia.

Design, synthesis and evaluation of diosgenin carbamate derivatives as multitarget anti-Alzheimer's disease agents.

Yun Tang, Jin Huang, Yan Huang, 2019, European journal of medicinal chemistry.

Pharmacological inhibition of dihydroorotate dehydrogenase induces apoptosis and differentiation in acute myeloid leukemia cells

R. Nussinov, Yechun Xu, F. Cheng, 2018, Haematologica.

Quantitative and systems pharmacology 2. In silico polypharmacology of G protein‐coupled receptor ligands via network‐based approaches

Xiufeng Pang, Feixiong Cheng, Zengrui Wu, 2017, Pharmacological research.

Identification of Inhibitors against p90 Ribosomal S6 Kinase 2 (RSK2) through Structure-Based Virtual Screening with the Inhibitor-Constrained Refined Homology Model

Zhenjiang Zhao, Yi Zhou, Jin Huang, 2011, J. Chem. Inf. Model..

Tiratricol, a thyroid hormone metabolite, has potent inhibitory activity against human dihydroorotate dehydrogenase

Jin Huang, Ying Huang, Hui Ma, 2023, Chemical biology & drug design.

Design, synthesis, X-ray crystallographic analysis, and biological evaluation of thiazole derivatives as potent and selective inhibitors of human dihydroorotate dehydrogenase.

Honglin Li, Xiaofeng Liu, Zhenjiang Zhao, 2015, Journal of medicinal chemistry.

Discovery of diverse human dihydroorotate dehydrogenase inhibitors as immunosuppressive agents by structure-based virtual screening.

Honglin Li, Jin Huang, Yufang Xu, 2012, Journal of medicinal chemistry.

Isoindole-1,3-dione derivatives as RSK2 inhibitors: synthesis, molecular docking simulation and SAR analysis

Honglin Li, Weiqiang Lu, Zhenjiang Zhao, 2016 .

Butyl 4-(butyryloxy)benzoate functions as a new selective estrogen receptor β agonist and induces GLUT4 expression in CHO-K1 cells

Jin Huang, Xu Shen, Hong Shen, 2008, The Journal of Steroid Biochemistry and Molecular Biology.

Selective ligands of estrogen receptor β discovered using pharmacophore mapping and structure-based virtual screening

Lei Chen, Jin Huang, Wei-hua Li, 2014, Acta Pharmacologica Sinica.

CH(II), a cerebroprotein hydrolysate, exhibits potential neuro-protective effect on Alzheimer’s disease

Jin Huang, Yong Tang, Wanyan Wang, 2019, PloS one.

Metabolomic investigation of regional brain tissue dysfunctions induced by global cerebral ischemia

Jin Huang, Haiyan Zhang, Naixia Zhang, 2016, BMC Neuroscience.

Deoxyelephantopin inhibits cancer cell proliferation and functions as a selective partial agonist against PPARgamma.

Hualiang Jiang, Xu Shen, Jin Huang, 2008, Biochemical pharmacology.

Luciferase Reporter Gene Assay on Human 5-HT Receptor: Which Response Element Should Be Chosen?

Weiqiang Lu, Jin Huang, Dang Wu, 2015, Scientific Reports.

Inhibitors of HIV‐1 Integrase‐Human LEDGF/p75 Interaction Identified from Natural Products via Virtual Screening

Weihua Li, Guixia Liu, Yun Tang, 2012 .

2-Amido-3-(1H-Indol-3-yl)-N-Substitued-Propanamides as a New Class of Falcipain-2 Inhibitors. 1. Design, Synthesis, Biological Evaluation and Binding Model Studies

Hualiang Jiang, Honglin Li, Weiqiang Lu, 2009, Molecules.

Discovery of potent ligands for estrogen receptor beta by structure-based virtual screening.

Weihua Li, Jin Huang, Yun Tang, 2010, Journal of medicinal chemistry.

Revelation of AbfR in regulation of mismatch repair and energy metabolism in S. epidermidis by integrated proteomic and metabolomic analysis.

Cai-Guang Yang, Jin Huang, Jing Zheng, 2020, Journal of proteomics.

Metabolomic investigation of regional brain tissue dysfunctions induced by global cerebral ischemia

Jin Huang, Haiyan Zhang, Naixia Zhang, 2016, BMC Neuroscience.

wSDTNBI: a novel network-based inference method for virtual screening

Weihua Li, Zengrui Wu, Guixia Liu, 2021, Chemical Science.

Selective targeting p53WT lung cancer cells harboring homozygous p53 Arg72 by an inhibitor of CypA

H. Jiang, Mingyao Liu, Weiqiang Lu, 2017, Oncogene.

A fluorimetric assay for human reticulocyte 15-lipoxygenase-1 activity.

Weiqiang Lu, Jin Huang, S. Zou, 2012, Analytical biochemistry.

Identification of novel falcipain-2 inhibitors as potential antimalarial agents through structure-based virtual screening.

Hualiang Jiang, Xu Shen, Honglin Li, 2009, Journal of medicinal chemistry.

F. Cheng, Yun Tang, Mingyao Liu, 2017, Journal of medicinal chemistry.

2-Arylbenzo[b]furan derivatives as potent human lipoxygenase inhibitors

Yun Tang, Weiqiang Lu, Jin Huang, 2016, Journal of enzyme inhibition and medicinal chemistry.

Target identi ﬁ cation among known drugs by deep learning from heterogeneous networks †

R. Nussinov, F. Cheng, Yadi Zhou, 2020 .

Discovery and structure-activity analysis of selective estrogen receptor modulators via similarity-based virtual screening.

Jin Huang, Yun Tang, Guixia Liu, 2012, European journal of medicinal chemistry.