Molecular modeling, dynamic simulation, and metabolic reactivity studies of quinazoline derivatives to investigate their anti-angiogenic potential by targeting wild EGFR<sup>wt</sup> and mutant EGFR<sup>T790M</sup> receptor tyrosine kinases.

Shah, Altaf Ahmad; Kumar, Nitish; Mohinder Singh Bedi, Preet; Akhtar, Salman

Molecular modeling, dynamic simulation, and metabolic reactivity studies of quinazoline derivatives to investigate their anti-angiogenic potential by targeting wild EGFR^wt and mutant EGFR^T790M receptor tyrosine kinases.

Shah, Altaf Ahmad; Kumar, Nitish; Mohinder Singh Bedi, Preet; Akhtar, Salman.

Afiliação

Shah AA; Department of Biosciences, Integral University, Lucknow, India.
Kumar N; Department of Pharmaceutical Sciences, Guru Nanak Dev University, Amritsar, India.
Mohinder Singh Bedi P; Department of Pharmaceutical Sciences, Guru Nanak Dev University, Amritsar, India.
Akhtar S; Department of Bioengineering, Integral University, Lucknow, India.

J Biomol Struct Dyn ; : 1-23, 2023 Nov 03.

Article em En | MEDLINE | ID: mdl-37921704

Palavras-chave

Tumor-angiogenesis; cardiotoxicity; epidermal growth factor receptor; kinase domain; metabolic reactivity; molecular docking; molecular dynamics simulation; quinazolines

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Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article

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Texto completo: 1 Base de dados: MEDLINE Idioma: En Ano de publicação: 2023 Tipo de documento: Article