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OJVRTM
Online Journal of
Veterinary Research ©
(Including Medical and Laboratory Research)
Established 1994
ISSN 1328-925X
Volume 28 (1): 43-49,
2024.
Flavopiridol virtual
inhibitor for cell division control protein analogs.
Darakhshan Jabin,
Ambarish Sharan, Vidyarthi Shankaracharya.
Department of Biotechnology,
Birla Institute of Technology, Mesra, Ranchi,
Jharkhand - 835 215, India
Jabin D, Shara
A, Shankaracharya V., Flavopiridol virtual inhibitor of cell division control
protein analogs. Onl J Vet Res., 28 (1):43-49,
2024.
Cell division control protein 2 (Cdc2) a catalytic subunit of M-phase promoting
factor (MPF) is essential for G1/S and G2/M phase transitions of eukaryotic
cell cycle. We report an inhibitor of Cdc2 by
virtual screening, flexible docking GLIDE and ADME prediction of 10 prioritized
analogues based on GScore. Flavopiridol
(N-methylpiperidinyl, chlorophenyl
flavones) inhibit cell cycle
progression in either G1 or G2 and work as potent cyclin-dependent kinase (CDK)
inhibitor. Results suggested that of 100 compounds investigated ZINC_18825325
was most suitable with a GScore of -9.63 with ADME.
Results of toxicity prediction are provided
Keywords: Flavopiridol, Cdc2, Molecular Docking, ADME, Toxicity
Prediction.
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