Identification of a μ-δ opioid receptor heteromer-biased agonist with antinociceptive activity

I Gomes, W Fujita, A Gupta… - Proceedings of the …, 2013 - National Acad Sciences
G protein-coupled receptors play a pivotal role in many physiological signaling pathways.
Mounting evidence suggests that G protein-coupled receptors, including opioid receptors …

Inferring multi-target QSAR models with taxonomy-based multi-task learning

L Rosenbaum, A Dörr, MR Bauer, FM Boeckler… - Journal of …, 2013 - Springer
Background A plethora of studies indicate that the development of multi-target drugs is
beneficial for complex diseases like cancer. Accurate QSAR models for each of the desired …

Are phylogenetic trees suitable for chemogenomics analyses of bioactivity data sets: the importance of shared active compounds and choosing a suitable data …

S Paricharak, T Klenka, M Augustin, UA Patel… - Journal of …, 2013 - Springer
Background 'Phylogenetic trees' are commonly used for the analysis of chemogenomics
datasets and to relate protein targets to each other, based on the (shared) bioactivities of …

[PDF][PDF] Ivone Gomesa, Wakako Fujitaa, Achla Guptaa, S. Adrian Saldanhab, Ana Negric, Christine E. Pinellob, Christina Eberhartb, Edward Robertsd, Marta Filizolac …

S Volkensteina, K Oshimaa, ST Sinkkonena… - PNAS, 2013 - researchgate.net
Correction for “Transient, afferent input-dependent, postnatal niche for neural progenitor
cells in the cochlear nucleus,” by Stefan Volkenstein, Kazuo Oshima, Saku T. Sinkkonen, C …

Improving drug discovery using a neural networks based parallel scoring function

H Pérez-Sánchez, GD Guerrero… - … Joint Conference on …, 2013 - ieeexplore.ieee.org
Virtual Screening (VS) methods can considerably aid clinical research, predicting how
ligands interact with drug targets. Most VS methods suppose a unique binding site for the …

Computational approaches to predicting drug induced toxicity

RL Marchese Robinson - 2013 - repository.cam.ac.uk
Novel approaches and models for predicting drug induced toxicity in silico are presented.
Typically, these were based on Quantitative Structure-Activity Relationships (QSAR). The …

[引用][C] CATS for Scaffold Hopping in Medicinal Chemistry

CP Koch, M Reutlinger, N Todoroff… - Scaffold Hopping in …, 2013 - Wiley Online Library
CATS for Scaffold Hopping in Medicinal Chemistry Page 1 7 CATS for Scaffold Hopping in
Medicinal Chemistry Christian P. Koch, Michael Reutlinger, Nickolay Todoroff, Petra Schneider …