Detalhe da pesquisa
1.
Prediction of drug-induced liver injury and cardiotoxicity using chemical structure and in vitro assay data.
Toxicol Appl Pharmacol
; 454: 116250, 2022 11 01.
Artigo
em Inglês
| MEDLINE | ID: mdl-36150479
2.
Using in vitro ADME data for lead compound selection: An emphasis on PAMPA pH 5 permeability and oral bioavailability.
Bioorg Med Chem
; 56: 116588, 2022 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-35030421
3.
Novel Consensus Architecture To Improve Performance of Large-Scale Multitask Deep Learning QSAR Models.
J Chem Inf Model
; 59(11): 4613-4624, 2019 11 25.
Artigo
em Inglês
| MEDLINE | ID: mdl-31584270
4.
Drug Repurposing Screen for Compounds Inhibiting the Cytopathic Effect of SARS-CoV-2.
bioRxiv
; 2020 Aug 18.
Artigo
em Inglês
| MEDLINE | ID: mdl-32839771
5.
Drug Repurposing Screen for Compounds Inhibiting the Cytopathic Effect of SARS-CoV-2.
Front Pharmacol
; 11: 592737, 2020.
Artigo
em Inglês
| MEDLINE | ID: mdl-33708112
6.
An OpenData portal to share COVID-19 drug repurposing data in real time.
bioRxiv
; 2020 Jun 05.
Artigo
em Inglês
| MEDLINE | ID: mdl-32511420
7.
The NCATS Pharmaceutical Collection: a 10-year update.
Drug Discov Today
; 24(12): 2341-2349, 2019 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-31585169
8.
The NCATS BioPlanet - An Integrated Platform for Exploring the Universe of Cellular Signaling Pathways for Toxicology, Systems Biology, and Chemical Genomics.
Front Pharmacol
; 10: 445, 2019.
Artigo
em Inglês
| MEDLINE | ID: mdl-31133849
9.
Expanding biological space coverage enhances the prediction of drug adverse effects in human using in vitro activity profiles.
Sci Rep
; 8(1): 3783, 2018 02 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-29491351
10.
Canvass: A Crowd-Sourced, Natural-Product Screening Library for Exploring Biological Space.
ACS Cent Sci
; 4(12): 1727-1741, 2018 Dec 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-30648156
11.
Modelling the Tox21 10 K chemical profiles for in vivo toxicity prediction and mechanism characterization.
Nat Commun
; 7: 10425, 2016 Jan 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-26811972
12.
Profiling of the Tox21 10K compound library for agonists and antagonists of the estrogen receptor alpha signaling pathway.
Sci Rep
; 4: 5664, 2014 Jul 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-25012808