Non-Bisphosphonate Inhibitors of Isoprenoid Biosynthesis Identified via Computer-Aided Drug Design

Keywords

Farnesyl diphosphate synthase, ATP synthase, Bisphosphonate, Chemistry, Virtual screening

References

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Cited by

• Species Differences in Alternative Substrate Utilization by the Antibacterial Target Undecaprenyl Pyrophosphate SynthaseJ. Fernandez — 2014
• Novel cruzain inhibitors for the treatment of Chagas’ diseaseKathleen E. Rogers, Henrik Keränen, Jacob D. Durrant — 2012
• Antagonism screen for inhibitors of bacterial cell wall biogenesis uncovers an inhibitor of undecaprenyl diphosphate synthaseMaya A. Farha, Tomasz L. Czarny, Cullen L. Myers — 2015
• Antibacterial drug leads targeting isoprenoid biosynthesisWei Zhu, Yonghui Zhang, William Sinko — 2012
• Undecaprenyl Diphosphate Synthase Inhibitors: Antibacterial Drug LeadsWilliam Sinko, Yang Wang, Wei Zhu — 2014
• Discovery of Novel Inhibitors of HIV-1 Reverse Transcriptase Through Virtual Screening of Experimental and Theoretical EnsemblesAnthony Ivetac, Sara E. Swift, Paul L. Boyer — 2014
• Molecular Simulations of Aromatase Reveal New Insights Into the Mechanism of Ligand BindingJiho Park, Luke Czapla, Rommie E. Amaro — 2013
• Deciphering the Metabolism of Undecaprenyl-Phosphate: The Bacterial Cell-Wall Unit Carrier at the Membrane FrontierGuillaume Manat, Sophie Roure, Rodolphe Auger — 2014
• Exploring the Role of Receptor Flexibility in Structure-Based Drug DiscoveryFerran Feixas, Steffen Lindert, William Sinko — 2013
• Anti-Infectious Agents against MRSANobuhiro Koyama, Junji Inokoshi, Hiroshi Tomoda — 2012
• Spirohexalines, new inhibitors of bacterial undecaprenyl pyrophosphate synthase, produced by Penicillium brasilianum FKI-3368Junji Inokoshi, Yuichiro Nakamura, Zhang Hongbin — 2012
• Structure, function and inhibition of ent-kaurene synthase from Bradyrhizobium japonicumWenting Liu, Xinxin Feng, Yingying Zheng — 2014
• ST‐analyzer: A web‐based user interface for simulation trajectory analysisJong Cheol Jeong, Sunhwan Jo, Emilia L. Wu — 2014
• LigMerge: A Fast Algorithm to Generate Models of Novel Potential Ligands from Sets of Known BindersSteffen Lindert, Jacob D. Durrant, J. Andrew McCammon — 2012
• Isoprenoid biosynthesis in bacterial pathogens.Sinéad Heuston, Máire Begley, Cormac G. M. Gahan — 2012
• A Molecular Dynamics Investigation of Mycobacterium tuberculosis Prenyl Synthases: Conformational Flexibility, and Implications for Computer-Aided Drug DiscoveryMeekyum Olivia Kim, Xinxin Feng, Ferran Feixas — 2014
• Molecular dynamics simulations and drug discoveryJacob D. Durrant, J. Andrew McCammon — 2011
• Farnesyl diphosphate synthase inhibitors from in silico screeningSteffen Lindert, Wei Zhu, Yiliang Liu — 2013
• Antibacterial Drug Leads: DNA and Enzyme Multi-TargetingWei Zhu, Yang Wang, Kai Li — 2015
• Investigating the impact of missense mutations in hCES1 by in silico structure-based approachesGrace Shema Nzabonimpa, Henrik Berg Rasmussen, Søren Brunak — 2016

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