Detalhe da pesquisa
1.
High-Throughput Screening to Advance In Vitro Toxicology: Accomplishments, Challenges, and Future Directions.
Annu Rev Pharmacol Toxicol
; 64: 191-209, 2024 Jan 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-37506331
2.
NAD activates olfactory receptor 1386 to regulate type I interferon responses in Plasmodium yoelii YM infection.
Proc Natl Acad Sci U S A
; 121(23): e2403796121, 2024 Jun 04.
Artigo
em Inglês
| MEDLINE | ID: mdl-38809710
3.
Tautomeric cinnamoylphloroglucinol-monoterpene adducts from Cleistocalyx operculatus and their antiviral activities.
J Asian Nat Prod Res
; 26(1): 38-51, 2024 Jan.
Artigo
em Inglês
| MEDLINE | ID: mdl-38190257
4.
In vitro profiling of pesticides within the Tox21 10K compound library for bioactivity and potential toxicity.
Toxicol Appl Pharmacol
; 473: 116600, 2023 08 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-37321325
5.
Identification of Potent and Selective Acetylcholinesterase/Butyrylcholinesterase Inhibitors by Virtual Screening.
J Chem Inf Model
; 63(8): 2321-2330, 2023 04 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-37011147
6.
Predictive Models for Human Cytochrome P450 3A7 Selective Inhibitors and Substrates.
J Chem Inf Model
; 63(3): 846-855, 2023 02 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-36719788
7.
The E3 ubiquitin ligase MARCH1 regulates antimalaria immunity through interferon signaling and T cell activation.
Proc Natl Acad Sci U S A
; 117(28): 16567-16578, 2020 07 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-32606244
8.
Three-Dimensional Structural Insights Have Revealed the Distinct Binding Interactions of Agonists, Partial Agonists, and Antagonists with the µ Opioid Receptor.
Int J Mol Sci
; 24(8)2023 Apr 11.
Artigo
em Inglês
| MEDLINE | ID: mdl-37108204
9.
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
10.
High-Throughput Platform for Novel Reaction Discovery.
Chemistry
; 28(50): e202201421, 2022 Sep 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-35766989
11.
Retro Drug Design: From Target Properties to Molecular Structures.
J Chem Inf Model
; 62(11): 2659-2669, 2022 06 13.
Artigo
em Inglês
| MEDLINE | ID: mdl-35653613
12.
Identification of environmental chemicals that activate p53 signaling after in vitro metabolic activation.
Arch Toxicol
; 96(7): 1975-1987, 2022 07.
Artigo
em Inglês
| MEDLINE | ID: mdl-35435491
13.
A Universal and High-Throughput Proteomics Sample Preparation Platform.
Anal Chem
; 93(24): 8423-8431, 2021 06 22.
Artigo
em Inglês
| MEDLINE | ID: mdl-34110797
14.
Development of Robust Quantitative Structure-Activity Relationship Models for CYP2C9, CYP2D6, and CYP3A4 Catalysis and Inhibition.
Drug Metab Dispos
; 49(9): 822-832, 2021 09.
Artigo
em Inglês
| MEDLINE | ID: mdl-34183376
15.
Deep Graph Learning with Property Augmentation for Predicting Drug-Induced Liver Injury.
Chem Res Toxicol
; 34(2): 495-506, 2021 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33347312
16.
Systematic Identification of Molecular Targets and Pathways Related to Human Organ Level Toxicity.
Chem Res Toxicol
; 34(2): 412-421, 2021 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33251791
17.
Trade-off Predictivity and Explainability for Machine-Learning Powered Predictive Toxicology: An in-Depth Investigation with Tox21 Data Sets.
Chem Res Toxicol
; 34(2): 541-549, 2021 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33513003
18.
The Tox21 10K Compound Library: Collaborative Chemistry Advancing Toxicology.
Chem Res Toxicol
; 34(2): 189-216, 2021 02 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33140634
19.
Application of niclosamide and analogs as small molecule inhibitors of Zika virus and SARS-CoV-2 infection.
Bioorg Med Chem Lett
; 40: 127906, 2021 05 15.
Artigo
em Inglês
| MEDLINE | ID: mdl-33689873
20.
Predictive Models to Identify Small Molecule Activators and Inhibitors of Opioid Receptors.
J Chem Inf Model
; 61(6): 2675-2685, 2021 06 28.
Artigo
em Inglês
| MEDLINE | ID: mdl-34047186