标题
Chalcone Derivatives: Promising Starting Points for Drug Design
作者
关键词
-
出版物
MOLECULES
Volume 22, Issue 8, Pages 1210
出版商
MDPI AG
发表日期
2017-07-25
DOI
10.3390/molecules22081210
参考文献
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注意:仅列出部分参考文献,下载原文获取全部文献信息。- QSAR-driven design, synthesis and discovery of potent chalcone derivatives with antitubercular activity
- (2017) Marcelo N. Gomes et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- Phantom PAINS: Problems with the Utility of Alerts for Pan-Assay INterference CompoundS
- (2017) Stephen J. Capuzzi et al. Journal of Chemical Information and Modeling
- Targeting Class I Histone Deacetylases in a “Complex” Environment
- (2017) Christopher J. Millard et al. TRENDS IN PHARMACOLOGICAL SCIENCES
- Synthesis and anti-proliferative activity of fluoro-substituted chalcones
- (2016) Serdar Burmaoglu et al. BIOORGANIC & MEDICINAL CHEMISTRY LETTERS
- Filtering promiscuous compounds in early drug discovery: is it a good idea?
- (2016) Mario R. Senger et al. DRUG DISCOVERY TODAY
- Structure based medicinal chemistry-driven strategy to design substituted dihydropyrimidines as potential antileishmanial agents
- (2016) Umer Rashid et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- Modern approaches to accelerate discovery of new antischistosomal drugs
- (2016) Bruno Junior Neves et al. Expert Opinion on Drug Discovery
- QSAR-Driven Discovery of Novel Chemical Scaffolds Active against Schistosoma mansoni
- (2016) Cleber C. Melo-Filho et al. Journal of Chemical Information and Modeling
- Trust, but Verify II: A Practical Guide to Chemogenomics Data Curation
- (2016) Denis Fourches et al. Journal of Chemical Information and Modeling
- Discovery of New Anti-Schistosomal Hits by Integration of QSAR-Based Virtual Screening and High Content Screening
- (2016) Bruno J. Neves et al. JOURNAL OF MEDICINAL CHEMISTRY
- Targeting histone deacetylases in T-cell lymphoma
- (2016) Alison J. Moskowitz et al. LEUKEMIA & LYMPHOMA
- QM/MM free energy simulations: recent progress and challenges
- (2016) Xiya Lu et al. MOLECULAR SIMULATION
- Continuous-Flow Synthesis of Deuterium-Labeled Antidiabetic Chalcones: Studies towards the Selective Deuteration of the Alkynone Core
- (2016) Sándor Ötvös et al. MOLECULES
- Antivascular and antitumor properties of the tubulin-binding chalcone TUB091
- (2016) María-Dolores Canela et al. Oncotarget
- Synthesis and biological evaluation of novel hybrid compounds between chalcone and piperazine as potential antitumor agents
- (2016) Zewei Mao et al. RSC Advances
- Computational Design of a Time-Dependent Histone Deacetylase 2 Selective Inhibitor
- (2015) Jingwei Zhou et al. ACS Chemical Biology
- Receptor-based virtual screening protocol for drug discovery
- (2015) Nuno M.F.S.A. Cerqueira et al. ARCHIVES OF BIOCHEMISTRY AND BIOPHYSICS
- Role of computer-aided drug design in modern drug discovery
- (2015) Stephani Joy Y. Macalino et al. ARCHIVES OF PHARMACAL RESEARCH
- Building a virtual ligand screening pipeline using free software: a survey
- (2015) Enrico Glaab BRIEFINGS IN BIOINFORMATICS
- Chalcone scaffolds as anti-infective agents: Structural and molecular target perspectives
- (2015) Debarshi Kar Mahapatra et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- An overview of molecular fingerprint similarity search in virtual screening
- (2015) Ingo Muegge et al. Expert Opinion on Drug Discovery
- Protein Flexibility in Docking-Based Virtual Screening: Discovery of Novel Lymphoid-Specific Tyrosine Phosphatase Inhibitors Using Multiple Crystal Structures
- (2015) Xuben Hou et al. Journal of Chemical Information and Modeling
- Methods for generating and applying pharmacophore models as virtual screening filters and for bioactivity profiling
- (2015) Anna Vuorinen et al. METHODS
- Molecular fingerprint similarity search in virtual screening
- (2015) Adrià Cereto-Massagué et al. METHODS
- The Prodrug Approach: A Successful Tool for Improving Drug Solubility
- (2015) Daniela Jornada et al. MOLECULES
- Molecular Docking and Structure-Based Drug Design Strategies
- (2015) Leonardo Ferreira et al. MOLECULES
- Deep learning
- (2015) Yann LeCun et al. NATURE
- Curation of chemogenomics data
- (2015) Denis Fourches et al. Nature Chemical Biology
- Highly Selective Continuous-Flow Synthesis of Potentially Bioactive Deuterated Chalcone Derivatives
- (2015) Chi-Ting Hsieh et al. ChemPlusChem
- Tubulin inhibitors: pharmacophore modeling, virtual screening and molecular docking
- (2014) Miao-miao Niu et al. ACTA PHARMACOLOGICA SINICA
- Malarial hemozoin: From target to tool
- (2014) Lorena M. Coronado et al. BIOCHIMICA ET BIOPHYSICA ACTA-GENERAL SUBJECTS
- Impact of Computational Structure-based Methods on Drug Discovery
- (2014) Charles Reynolds CURRENT PHARMACEUTICAL DESIGN
- Structure-Based Virtual Screening for Drug Discovery: Principles, Applications and Recent Advances
- (2014) Evanthia Lionta et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Design and synthesis of novel indole-chalcone fibrates as lipid lowering agents
- (2014) Koneni V. Sashidhara et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- The RCSB Protein Data Bank: views of structural biology for basic and applied research and education
- (2014) Peter W. Rose et al. NUCLEIC ACIDS RESEARCH
- Peroxisome proliferator-activated receptors and their ligands: nutritional and clinical implications - a review
- (2014) Bogna Grygiel-Górniak Nutrition Journal
- Machine learning methods in chemoinformatics
- (2014) John B. O. Mitchell Wiley Interdisciplinary Reviews-Computational Molecular Science
- The Role of Fibrate Treatment in Dyslipidemia: An Overview
- (2013) Niki Katsiki et al. CURRENT PHARMACEUTICAL DESIGN
- The Role of Protonation States in Ligand-Receptor Recognition and Binding
- (2013) Marharyta Petukh et al. CURRENT PHARMACEUTICAL DESIGN
- Assessing the Performance of 3D Pharmacophore Models in Virtual Screening: How Good are They?
- (2013) Rodolpho C. Braga et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Methods and Applications of Structure Based Pharmacophores in Drug Discovery
- (2013) Somayeh Pirhadi et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- How far can virtual screening take us in drug discovery?
- (2013) Supratik Kar et al. Expert Opinion on Drug Discovery
- Quantitative analysis of phenolic metabolites from different parts of Angelica keiskei by HPLC–ESI MS/MS and their xanthine oxidase inhibition
- (2013) Dae Wook Kim et al. FOOD CHEMISTRY
- Drug resistance in leishmaniasis: current drug-delivery systems and future perspectives
- (2013) Masoom Yasinzai et al. Future Medicinal Chemistry
- QSAR Modeling: Where Have You Been? Where Are You Going To?
- (2013) Artem Cherkasov et al. JOURNAL OF MEDICINAL CHEMISTRY
- Application of the Suzuki-Miyaura Reaction in the Synthesis of Flavonoids
- (2013) Mamoalosi Selepe et al. MOLECULES
- Modelling and enhanced molecular dynamics to steer structure-based drug discovery
- (2013) Subha Kalyaanamoorthy et al. PROGRESS IN BIOPHYSICS & MOLECULAR BIOLOGY
- Antimitotic Chalcones and Related Compounds as Inhibitors of Tubulin Assembly
- (2012) Sylvie Ducki Anti-Cancer Agents in Medicinal Chemistry
- Synthesis and in vitro evaluation of new chloroquine-chalcone hybrids against chloroquine-resistant strain of Plasmodium falciparum
- (2012) Koneni V. Sashidhara et al. BIOORGANIC & MEDICINAL CHEMISTRY LETTERS
- Exploring Pharmacological Significance of Chalcone Scaffold: A Review
- (2012) N. K. Sahu et al. CURRENT MEDICINAL CHEMISTRY
- Accommodating Protein Flexibility for Structure-Based Drug Design
- (2012) Jung-Hsin Lin CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Protein Flexibility and Ligand Recognition: Challenges for Molecular Modeling
- (2012) Francesca Spyrakis et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Similarity Coefficients for Binary Chemoinformatics Data: Overview and Extended Comparison Using Simulated and Real Data Sets
- (2012) Roberto Todeschini et al. Journal of Chemical Information and Modeling
- FRED and HYBRID docking performance on standardized datasets
- (2012) Mark McGann JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
- QSAR and QM/MM Approaches Applied to Drug Metabolism Prediction
- (2012) R. C. Braga et al. MINI-REVIEWS IN MEDICINAL CHEMISTRY
- Reactivity assessment of chalcones by a kinetic thiol assay
- (2012) Sabine Amslinger et al. ORGANIC & BIOMOLECULAR CHEMISTRY
- Continuous-flow hydration–condensation reaction: Synthesis of α,β-unsaturated ketones from alkynes and aldehydes by using a heterogeneous solid acid catalyst
- (2011) Magnus Rueping et al. Beilstein Journal of Organic Chemistry
- Isoliquiritigenin, a chalcone compound, is a positive allosteric modulator of GABAA receptors and shows hypnotic effects
- (2011) Suengmok Cho et al. BIOCHEMICAL AND BIOPHYSICAL RESEARCH COMMUNICATIONS
- Microwave assisted solvent free synthesis of 1,3-diphenylpropenones
- (2011) Dwipen Kakati et al. Chemistry Central Journal
- Pharmacophore Modelling: A Forty Year Old Approach and its Modern Synergies
- (2011) F. Caporuscio et al. CURRENT MEDICINAL CHEMISTRY
- State-of-the-art in ligand-based virtual screening
- (2011) Peter Ripphausen et al. DRUG DISCOVERY TODAY
- Structure-based drug design to augment hit discovery
- (2011) Subha Kalyaanamoorthy et al. DRUG DISCOVERY TODAY
- Software and resources for computational medicinal chemistry
- (2011) Chenzhong Liao et al. Future Medicinal Chemistry
- Recent advances in leishmaniasis treatment
- (2011) Tatiana S. Tiuman et al. INTERNATIONAL JOURNAL OF INFECTIOUS DISEASES
- Synopsis of Some Recent Tactical Application of Bioisosteres in Drug Design
- (2011) Nicholas A. Meanwell JOURNAL OF MEDICINAL CHEMISTRY
- Structure-Based Pharmacophores for Virtual Screening
- (2011) Martin Löwer et al. Molecular Informatics
- Antiobesity and lipid lowering effects of Glycyrrhiza chalcones: Experimental and computational studies
- (2011) Rahul B. Birari et al. PHYTOMEDICINE
- Systematic placement of structural water molecules for improved scoring of protein-ligand interactions
- (2011) D. J. Huggins et al. PROTEIN ENGINEERING DESIGN & SELECTION
- Prodrugs of a CXC Chemokine-12 (CXCL12) Neutraligand Prevent Inflammatory Reactions in an Asthma Model in Vivo
- (2011) Vincent Gasparik et al. ACS Medicinal Chemistry Letters
- Synthesis and antihyperlipidemic activity of novel coumarin bisindole derivatives
- (2010) Koneni V. Sashidhara et al. BIOORGANIC & MEDICINAL CHEMISTRY LETTERS
- Principles of early drug discovery
- (2010) JP Hughes et al. BRITISH JOURNAL OF PHARMACOLOGY
- Prediction of Michael-Type Acceptor Reactivity toward Glutathione
- (2010) Johannes A. H. Schwöbel et al. CHEMICAL RESEARCH IN TOXICOLOGY
- Quantum Mechanical Methods for Drug Design
- (2010) Ting Zhou et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Synthesis and biological evaluation of novel hybrid chalcone derivatives as vasorelaxant agents
- (2010) Xiaowu Dong et al. EUROPEAN JOURNAL OF MEDICINAL CHEMISTRY
- Virtual screening with AutoDock: theory and practice
- (2010) Sandro Cosconati et al. Expert Opinion on Drug Discovery
- Per aspera ad astra: application of Simplex QSAR approach in antiviral research
- (2010) Eugene N Muratov et al. Future Medicinal Chemistry
- Molecular docking, structure–activity relationship and biological evaluation of the anticancer drug monastrol as a pteridine reductase inhibitor in a clinical isolate of Leishmania donovani
- (2010) Jaspreet Kaur et al. JOURNAL OF ANTIMICROBIAL CHEMOTHERAPY
- Trust, But Verify: On the Importance of Chemical Structure Curation in Cheminformatics and QSAR Modeling Research
- (2010) Denis Fourches et al. Journal of Chemical Information and Modeling
- pKa based protonation states and microspecies for protein–ligand docking
- (2010) Tim ten Brink et al. JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN
- Sofalcone, a gastroprotective drug, promotes gastric ulcer healing following eradication therapy for Helicobacter pylori: A randomized controlled comparative trial with cimetidine, an H2-receptor antagonist
- (2010) Kazuhide Higuchi et al. JOURNAL OF GASTROENTEROLOGY AND HEPATOLOGY
- New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays
- (2010) Jonathan B. Baell et al. JOURNAL OF MEDICINAL CHEMISTRY
- A Proton-Shuttle Reaction Mechanism for Histone Deacetylase 8 and the Catalytic Role of Metal Ions
- (2010) Ruibo Wu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Development of a General Palladium-Catalyzed Carbonylative Heck Reaction of Aryl Halides
- (2010) Xiao-Feng Wu et al. JOURNAL OF THE AMERICAN CHEMICAL SOCIETY
- Bioisosteric Replacement and Scaffold Hopping in Lead Generation and Optimization
- (2010) Sarah R. Langdon et al. Molecular Informatics
- Best Practices for QSAR Model Development, Validation, and Exploitation
- (2010) Alexander Tropsha Molecular Informatics
- PharmMapper server: a web server for potential drug target identification using pharmacophore mapping approach
- (2010) Xiaofeng Liu et al. NUCLEIC ACIDS RESEARCH
- Design, Synthesis, and Biological Evaluation of Prenylated Chalcones as Vasorelaxant Agents
- (2009) Xiaowu Dong et al. ARCHIV DER PHARMAZIE
- Structure-Based Drug Design Strategies in Medicinal Chemistry
- (2009) Adriano Andricopulo et al. CURRENT TOPICS IN MEDICINAL CHEMISTRY
- Drug hybridization strategies: before or after lead identification?
- (2009) Carlos Alberto Manssour Fraga Expert Opinion on Drug Discovery
- Design, synthesis, and biological evaluation of thiophene analogues of chalcones
- (2008) Romeo Romagnoli et al. BIOORGANIC & MEDICINAL CHEMISTRY
- Leishmania donovani pteridine reductase 1: Biochemical properties and structure-modeling studies
- (2008) Pranav Kumar et al. EXPERIMENTAL PARASITOLOGY
- The use of fluvastatin in cardiovascular risk management
- (2008) Kenneth J McDonald et al. EXPERT OPINION ON PHARMACOTHERAPY
- Small Neutralizing Molecules to Inhibit Actions of the Chemokine CXCL12
- (2008) Muriel Hachet-Haas et al. JOURNAL OF BIOLOGICAL CHEMISTRY
- MM-GB/SA Rescoring of Docking Poses in Structure-Based Lead Optimization
- (2008) Cristiano R. W. Guimarães et al. Journal of Chemical Information and Modeling
- Ligand−Protein Docking with Water Molecules
- (2008) Benjamin C. Roberts et al. Journal of Chemical Information and Modeling
- The Many Roles for Fluorine in Medicinal Chemistry
- (2008) William K. Hagmann JOURNAL OF MEDICINAL CHEMISTRY
- C-Geranylated Chalcones from the Stems ofAngelicakeiskeiwith Superoxide-Scavenging Activity
- (2008) Nobuwa Aoki et al. JOURNAL OF NATURAL PRODUCTS
- Progress inAb InitioQM/MM Free-Energy Simulations of Electrostatic Energies in Proteins: Accelerated QM/MM Studies of pKa, Redox Reactions and Solvation Free Energies†
- (2008) Shina C. L. Kamerlin et al. JOURNAL OF PHYSICAL CHEMISTRY B
- Prodrugs: design and clinical applications
- (2008) Jarkko Rautio et al. NATURE REVIEWS DRUG DISCOVERY
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