Detalhe da pesquisa
1.
Artificial Intelligence for Drug Discovery: Are We There Yet?
Annu Rev Pharmacol Toxicol
; 64: 527-550, 2024 Jan 23.
Artigo
em Inglês
| MEDLINE | ID: mdl-37738505
2.
Analysis of non-mutagenic substances in the context of drug impurity assessment - Few are potent toxicants.
Regul Toxicol Pharmacol
; 150: 105645, 2024 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-38761967
3.
Toward Quantitative Models in Safety Assessment: A Case Study to Show Impact of Dose-Response Inference on hERG Inhibition Models.
Int J Mol Sci
; 24(1)2022 Dec 30.
Artigo
em Inglês
| MEDLINE | ID: mdl-36614078
4.
A cross-industry collaboration to assess if acute oral toxicity (Q)SAR models are fit-for-purpose for GHS classification and labelling.
Regul Toxicol Pharmacol
; 120: 104843, 2021 Mar.
Artigo
em Inglês
| MEDLINE | ID: mdl-33340644
5.
Management of pharmaceutical ICH M7 (Q)SAR predictions - The impact of model updates.
Regul Toxicol Pharmacol
; 118: 104807, 2020 Dec.
Artigo
em Inglês
| MEDLINE | ID: mdl-33058939
6.
Skin sensitization in silico protocol.
Regul Toxicol Pharmacol
; 116: 104688, 2020 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-32621976
7.
Extending (Q)SARs to incorporate proprietary knowledge for regulatory purposes: is aromatic N-oxide a structural alert for predicting DNA-reactive mutagenicity?
Mutagenesis
; 34(1): 67-82, 2019 03 06.
Artigo
em Inglês
| MEDLINE | ID: mdl-30189015
8.
Principles and procedures for handling out-of-domain and indeterminate results as part of ICH M7 recommended (Q)SAR analyses.
Regul Toxicol Pharmacol
; 102: 53-64, 2019 Mar.
Artigo
em Inglês
| MEDLINE | ID: mdl-30562600
9.
Genetic toxicology in silico protocol.
Regul Toxicol Pharmacol
; 107: 104403, 2019 Oct.
Artigo
em Inglês
| MEDLINE | ID: mdl-31195068
10.
Synchronous down-modulation of miR-17 family members is an early causative event in the retinal angiogenic switch.
Proc Natl Acad Sci U S A
; 112(12): 3770-5, 2015 Mar 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-25775553
11.
Corrigendum to a cross-industry collaboration to assess if acute toxicity (Q)SAR models are fit-for-purpose for GHS classification and labelling. Regulatory toxicology and pharmacology (2021) 104843.
Regul Toxicol Pharmacol
; 131: 105165, 2022 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-35474000
12.
Principles and procedures for implementation of ICH M7 recommended (Q)SAR analyses.
Regul Toxicol Pharmacol
; 77: 13-24, 2016 Jun.
Artigo
em Inglês
| MEDLINE | ID: mdl-26877192
13.
Assessment of machine learning reliability methods for quantifying the applicability domain of QSAR regression models.
J Chem Inf Model
; 54(2): 431-41, 2014 Feb 24.
Artigo
em Inglês
| MEDLINE | ID: mdl-24490838
14.
Discovery of TRPA1 Antagonist GDC-6599: Derisking Preclinical Toxicity and Aldehyde Oxidase Metabolism with a Potential First-in-Class Therapy for Respiratory Disease.
J Med Chem
; 67(5): 3287-3306, 2024 Mar 14.
Artigo
em Inglês
| MEDLINE | ID: mdl-38431835
15.
Localized heuristic inverse quantitative structure activity relationship with bulk descriptors using numerical gradients.
J Chem Inf Model
; 53(8): 2001-17, 2013 Aug 26.
Artigo
em Inglês
| MEDLINE | ID: mdl-23845139
16.
In silico methods combined with expert knowledge rule out mutagenic potential of pharmaceutical impurities: an industry survey.
Regul Toxicol Pharmacol
; 62(3): 449-55, 2012 Apr.
Artigo
em Inglês
| MEDLINE | ID: mdl-22321701
17.
Development of Duration-Based Non-Mutagenic Thresholds of Toxicological Concern (TTCs) Relevant to Parenteral Extractables and Leachables (E&Ls).
PDA J Pharm Sci Technol
; 76(5): 369-383, 2022.
Artigo
em Inglês
| MEDLINE | ID: mdl-35031541
18.
Explanation for main features of structure-genotoxicity relationships of aromatic amines by theoretical studies of their activation pathways in CYP1A2.
J Am Chem Soc
; 133(40): 16168-85, 2011 Oct 12.
Artigo
em Inglês
| MEDLINE | ID: mdl-21894985
19.
Computational Toxicology and Drug Discovery.
Methods Mol Biol
; 1800: 233-244, 2018.
Artigo
em Inglês
| MEDLINE | ID: mdl-29934896
20.
Towards in vitro models for reducing or replacing the use of animals in drug testing.
Nat Biomed Eng
; 2023 Dec 27.
Artigo
em Inglês
| MEDLINE | ID: mdl-38151640