IrCytoToxDB: a dataset of iridium(III) complexes cytotoxicities against various cell lines.


Journal

Scientific data
ISSN: 2052-4463
Titre abrégé: Sci Data
Pays: England
ID NLM: 101640192

Informations de publication

Date de publication:
10 Aug 2024
Historique:
received: 04 04 2024
accepted: 02 08 2024
medline: 11 8 2024
pubmed: 11 8 2024
entrez: 10 8 2024
Statut: epublish

Résumé

Iridium(III) complexes nowadays became rising stars in various health-related applications. Thus, there is a necessity to assess cytotoxicity of the synthesized molecules against cancer/normal cell lines. In this report, we present a dataset of 2694 experimental cytotoxicity values of 803 iridium complexes against 127 different cell lines. We specify the experimental conditions and provide representation of the complexes molecules in machine-readable format. The dataset provides a starting point for exploration of new iridium-based cellular probes and opens new possibilities for predictions of toxicities and data-driven generation of new organometallic anticancer agents.

Identifiants

pubmed: 39127782
doi: 10.1038/s41597-024-03735-w
pii: 10.1038/s41597-024-03735-w
doi:

Substances chimiques

Iridium 44448S9773
Antineoplastic Agents 0
Coordination Complexes 0

Types de publication

Dataset Journal Article

Langues

eng

Sous-ensembles de citation

IM

Pagination

870

Informations de copyright

© 2024. The Author(s).

Références

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Auteurs

Lev Krasnov (L)

N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Leninskii pr. 31, Moscow, 119991, Russia.

Sergei Tatarin (S)

N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Leninskii pr. 31, Moscow, 119991, Russia.

Daniil Smirnov (D)

N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Leninskii pr. 31, Moscow, 119991, Russia.

Stanislav Bezzubov (S)

N.S. Kurnakov Institute of General and Inorganic Chemistry, Russian Academy of Sciences, Leninskii pr. 31, Moscow, 119991, Russia. bezzubov@igic.ras.ru.

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