Harmonization of QSAR Best Practices and Molecular Docking Provides an Efficient Virtual Screening Tool for Discovering New G-Quadruplex Ligands-Reference-Cited by-同舟云学术

Harmonization of QSAR Best Practices and Molecular Docking Provides an Efficient Virtual Screening Tool for Discovering New G-Quadruplex Ligands

Published:2015-09-18 Issue:10 Volume:55 Page:2094-2110
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Castillo-González Daimel¹²,Mergny Jean-Louis¹²,De Rache Aurore¹²,Pérez-Machado Gisselle³⁴⁵,Cabrera-Pérez Miguel Angel³⁵⁶,Nicolotti Orazio⁷,Introcaso Antonellina⁷,Mangiatordi Giuseppe Felice⁷,Guédin Aurore¹²,Bourdoncle Anne¹²,Garrigues Teresa⁵,Pallardó Federico⁴,Cordeiro M. Natália D. S.,Paz-y-Miño Cesar⁸,Tejera Eduardo⁸,Borges Fernanda,Cruz-Monteagudo Maykel⁸

Affiliation:

1. ARNA Laboratory, IECB, University of Bordeaux, F-33600 Pessac, France

2. ARNA Laboratory, INSERM, U869, F-33000 Bordeaux, France

3. Molecular Simulation and Drug Design Group, Centro de Bioactivos Químicos (CBQ), Central University of Las Villas, Santa Clara, Villa Clara 54830, Cuba

4. Department of Physiology, Faculty of Medicine, University of Valencia, Valencia 46010, Valencia, Spain

5. Department of Pharmacy and Pharmaceutical Technology, University of Valencia, Burjassot 46100, Valencia, Spain

6. Department of Engineering, Area of Pharmacy and Pharmaceutical Technology, Miguel Hernández University, 03550 Sant Joan d’Alacant, Alicante, Alicante, Spain

7. Dipartimento di Farmacia-Scienze, Università degli Studi di Bari “Aldo Moro″, Via Orabona 4, 70125 Bari, Bari, Italy

8. Instituto de Investigaciones Biomédicas (IIB), Universidad de Las Américas, 170513 Quito, Pichincha, Ecuador

Funder

Fundação para a Ciência e a Tecnologia

European Social Fund

Agencia Española de Cooperación Internacional para el Desarrollo

Publisher

American Chemical Society (ACS)

Subject

Library and Information Sciences,Computer Science Applications,General Chemical Engineering,General Chemistry

Link

https://pubs.acs.org/doi/pdf/10.1021/acs.jcim.5b00415

Reference107 articles.

1. Cell senescence and telomere shortening induced by a new series of specific G-quadruplex DNA ligands

2. The RNA Component of Human Telomerase

3. Pharmaceutical regulation of telomerase and its clinical potential

4. Recent Patents on Anti-Telomerase Cancer Therapy

Cited by 18 articles. 订阅此论文施引文献订阅此论文施引文献，注册后可以免费订阅5篇论文的施引文献，订阅后可以查看论文全部施引文献

1. In Silico Approaches in Pesticides;Trends and Innovations in Energetic Sources, Functional Compounds and Biotechnology;2023-12-01

2. Fragment library screening by X-ray crystallography and hit optimization against thioredoxin glutathione reductase of Schistosoma mansoni;2023-08-14

3. Maximizing the integration of virtual and experimental screening in hit discovery;Expert Opinion on Drug Discovery;2022-06-03

4. Identification of Kukoamine A, Zeaxanthin, and Clexane as New Furin Inhibitors;International Journal of Molecular Sciences;2022-03-03

5. Triazolyl Dibenzo[ a,c ]phenazines Stabilize Telomeric G‐quadruplex and Inhibit Telomerase;Asian Journal of Organic Chemistry;2021-10-12