A deep learning framework for high-throughput mechanism-driven phenotype compound screening and its application to COVID-19 drug repurposing

TH Pham, Y Qiu, J Zeng, L **e, P Zhang - Nature machine intelligence, 2021 - nature.com
Phenotype-based compound screening has advantages over target-based drug discovery,
but is unscalable and lacks understanding of mechanism of drug action. A chemical-induced …

[HTML][HTML] Chemical-induced gene expression ranking and its application to pancreatic cancer drug repurposing

TH Pham, Y Qiu, J Liu, S Zimmer, E O'Neill, L **e… - Patterns, 2022 - cell.com
Chemical-induced gene expression profiles provide critical information of chemicals in a
biological system, thus offering new opportunities for drug discovery. Despite their success …

Exploring the use of compound-induced transcriptomic data generated from cell lines to predict compound activity toward molecular targets

B Baillif, J Wichard, O Méndez-Lucio… - Frontiers in …, 2020 - frontiersin.org
Pharmaceutical or phytopharmaceutical molecules rely on the interaction with one or more
specific molecular targets to induce their anticipated biological responses. Nonetheless …

A Bayesian approach to accurate and robust signature detection on LINCS L1000 data

Y Qiu, T Lu, H Lim, L **e - Bioinformatics, 2020 - academic.oup.com
Motivation LINCS L1000 dataset contains numerous cellular expression data induced by
large sets of perturbagens. Although it provides invaluable resources for drug discovery as …

Data Valuation with Gradient Similarity

NJ Evans, GB Mills, G Wu, X Song, S McWeeney - Ar**v, 2024 - pmc.ncbi.nlm.nih.gov
High-quality data is crucial for accurate machine learning and actionable analytics, however,
mislabeled or noisy data is a common problem in many domains. Distinguishing low-from …

Graph structured neural networks for perturbation biology

NJ Evans, GB Mills, G Wu, X Song, S McWeeney - bioRxiv, 2024 - pmc.ncbi.nlm.nih.gov
Computational modeling of perturbation biology identifies relationships between molecular
elements and cellular response, and an accurate understanding of these systems will …

Integrated analysis of a compendium of RNA-Seq datasets for splicing factors

P Yu, J Li, SP Deng, F Zhang, PN Grozdanov… - Scientific Data, 2020 - nature.com
A vast amount of public RNA-sequencing datasets have been generated and used widely to
study transcriptome mechanisms. These data offer precious opportunity for advancing …

A deep learning framework for high-throughput mechanism-driven phenotype compound screening

TH Pham, Y Qiu, J Zeng, L **e, P Zhang - bioRxiv, 2020 - pmc.ncbi.nlm.nih.gov
Target-based high-throughput compound screening dominates conventional one-drug-one-
gene drug discovery process. However, the readout from the chemical modulation of a …

RBPMetaDB: a comprehensive annotation of mouse RNA-Seq datasets with perturbations of RNA-binding proteins

J Li, SP Deng, J Vieira, J Thomas, V Costa… - Database, 2018 - academic.oup.com
RNA-binding proteins (RBPs) may play a critical role in gene regulation in various diseases
or biological processes by controlling post-transcriptional events such as polyadenylation …

[BOOK][B] Prediction of compound-induced differential gene expression using graph neural networks

SA Memon - 2024 - search.proquest.com
Over the years, the increasing accessibility of gene expression profiling data has paved the
way for targeted therapy as a promising approach in cancer treatment, utilizing targeted …