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OJBTM
Online Journal of Bioinformatics ©
Volume 12(1):98-106, 2011
Virtual
human MEK1 protein inhibitors catechin and gw8510.
Vijayasree Potluri (MSc), Dibyabhaba Pradhan (MSc) and Amineni
Umamaheswari (PhD)*
SVIMS Bioinformatics Centre, Department of
Bioinformatics, SVIMS University, Tirupati, India
ABSTRACT
Potluri V, Pradhan D, Umamaheswari
A, Virtual human MEK1 protein inhibitors catechin and gw8510. Online J Bioinformatics, 12(1):98-106, 2011.
Identification of
inhibitors of human MEK1 protein could be used to design drugs against
melanoma. Virtual screening revealed 8 potential lead molecules which were
ranked on XP Gscore and binding orientation that
correlated with 4 known inhibitors. Docking results suggested that catechin 10.98 Kcal/mol and
gw8510 9.91 Kcal/mol could be potential inhibitors of MEK1 protein.
Key words: MEK1, dual specificity kinase,
docking, catechin, gw8510.
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