Virtual Fragment Screening: Discovery of Histamine H3 Receptor Ligands Using Ligand-Based and Protein-Based Molecular Fingerprints-Reference-Cited by-同舟云学术

Virtual Fragment Screening: Discovery of Histamine H3 Receptor Ligands Using Ligand-Based and Protein-Based Molecular Fingerprints

Published:2012-12-03 Issue:12 Volume:52 Page:3308-3324
ISSN:1549-9596
Container-title:Journal of Chemical Information and Modeling
language:en
Short-container-title:J. Chem. Inf. Model.

Author:

Sirci Francesco¹,Istyastono Enade P.²³,Vischer Henry F.²,Kooistra Albert J.²,Nijmeijer Saskia²,Kuijer Martien²,Wijtmans Maikel²,Mannhold Raimund⁴,Leurs Rob²,de Esch Iwan J. P.²,de Graaf Chris²

Affiliation:

1. Laboratory for Chemometrics and Chemoinformatics, Chemistry Department, University of Perugia, Via Elce di Sotto, 10, I-06123 Perugia Italy

2. Division of Medicinal Chemistry, Faculty of Sciences, Amsterdam Institute for Molecules, Medicines and Systems (AIMMS), VU University Amsterdam, De Boelelaan 1083, 1081 HV Amsterdam, The Netherlands.

3. Molecular Modeling Division, Pharmaceutical Technology Laboratory, Universitas Sanata Dharma, Yogyakarta, Indonesia

4. Department of Laser Medicine, Molecular Drug Research Group, Heinrich-Heine-Universität, Universitätsstrasse 1, D-40225 Düsseldorf, Germany

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/ci3004094

Reference108 articles.

1. Fragment library screening reveals remarkable similarities between the G protein-coupled receptor histamine H4 and the ion channel serotonin 5-HT3A

2. A ‘Rule of Three’ for fragment-based lead discovery?

3. Experiences in fragment-based drug discovery

4. Transforming fragments into candidates: small becomes big in medicinal chemistry

Cited by 66 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. VirtuousPocketome: a computational tool for screening protein–ligand complexes to identify similar binding sites;Scientific Reports;2024-03-15

2. VirtuousPocketome: A Computational Tool for Screening Protein-ligand Complexes to Identify Similar Binding Sites;2023-12-13

3. Structure‐Based Drug Design for G Protein‐Coupled Receptors;Burger's Medicinal Chemistry and Drug Discovery;2021-04-28

4. PyPLIF HIPPOS-Assisted Prediction of Molecular Determinants of Ligand Binding to Receptors;Molecules;2021-04-22

5. Novel potent (dihydro)benzofuranyl piperazines as human histamine receptor ligands – Functional characterization and modeling studies on H3 and H4 receptors;Bioorganic & Medicinal Chemistry;2021-01