Improved QSAR models for PARP-1 inhibition using data balancing, interpretable machine learning, and matched molecular pair analysis-Reference-Cited by-同舟云学术

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Improved QSAR models for PARP-1 inhibition using data balancing, interpretable machine learning, and matched molecular pair analysis

Published:2024-02-20 Issue: Volume: Page:
ISSN:1381-1991
Container-title:Molecular Diversity
language:en
Short-container-title:Mol Divers

Author:

Gomatam Anish,Hirlekar Bhakti Umesh,Singh Krishan Dev,Murty Upadhyayula Suryanarayana,Dixit Vaibhav A.

Funder

Ministry of Electronics and Information technology

National Institute of Pharmaceutical Education and Research Guwahati

Publisher

Springer Science and Business Media LLC

Link

https://link.springer.com/content/pdf/10.1007/s11030-024-10809-9.pdf

Reference83 articles.

1. Ossovskaya V, Koo IC, Kaldjian EP et al (2010) Upregulation of poly (ADP-Ribose) polymerase-1 (PARP1) in triple-negative breast cancer and other primary human tumor types. Genes Cancer 1:812–821. https://doi.org/10.1177/1947601910383418

2. Tong W-M, Cortes U, Wang Z-Q (2001) Poly(ADP-ribose) polymerase: a guardian angel protecting the genome and suppressing tumorigenesis. Biochim Biophys Acta. https://doi.org/10.1016/s0304-419x(01)00035-x

3. Miwa M, Masutani M (2007) PolyADP-ribosylation and cancer. Cancer Sci 98:1528–1535. https://doi.org/10.1111/j.1349-7006.2007.00567.x

4. Zhao Y, Zhang LX, Jiang T et al (2020) The ups and downs of poly(ADP-ribose) polymerase-1 inhibitors in cancer therapy–Current progress and future direction. Eur J Med Chem 203:112570–112839. https://doi.org/10.1016/j.ejmech.2020.112570

5. Bruin MAC, Sonke GS, Beijnen JH, Huitema ADR (2022) Pharmacokinetics and pharmacodynamics of PARP inhibitors in oncology. Clin Pharmacokinet 61:1649–1675. https://doi.org/10.1007/s40262-022-01167-6

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