Computational identification of 2, 4-disubstituted amino-pyrimidines as L858R/T790M-EGFR double mutant inhibitors using pharmacophore mapping, molecular …
Pharmacophore modelling studies have been performed for a series of 2, 4-disubstituted-
pyrimidines derivatives as EGFR L858R/T790M tyrosine kinase inhibitors. The high scoring …
pyrimidines derivatives as EGFR L858R/T790M tyrosine kinase inhibitors. The high scoring …
Proteomic approaches for biomarker panels in cancer
C Tanase, R Albulescu, M Neagu - Journal of immunoassay and …, 2016 - Taylor & Francis
Proteomic technologies remain the main backbone of biomarkers discovery in cancer. The
continuous development of proteomic technologies also enlarges the bioinformatics domain …
continuous development of proteomic technologies also enlarges the bioinformatics domain …
Structure based virtual screening, 3D-QSAR, molecular dynamics and ADMET studies for selection of natural inhibitors against structural and non-structural targets of …
The transmission of mosquito-borne Chikungunya virus (CHIKV) has large epidemics
worldwide. Till date, there are neither anti-viral drugs nor vaccines available for the …
worldwide. Till date, there are neither anti-viral drugs nor vaccines available for the …
Docking and molecular dynamic simulations of Mithramycin-A and Tolfenamic acid against Sp1 and survivin
Therapeutic targeting of Sp1 transcription factor and survivin, are studied in various cancers
due to their consistent overexpression. These markers result in poorer cancer prognoses …
due to their consistent overexpression. These markers result in poorer cancer prognoses …
Diaryl ether derivative inhibits GPX4 expression levels to induce ferroptosis in thyroid cancer cells
D Pamarthy, SK Behera, S Swain… - Drug Development …, 2023 - Wiley Online Library
Papillary thyroid carcinoma contributes to about 80% of the total thyroid cancer cases.
BRAFV600E is a frequently occurring mutation in PTCs. Although several BRAF inhibitors …
BRAFV600E is a frequently occurring mutation in PTCs. Although several BRAF inhibitors …
[HTML][HTML] Alpha mangostin inhibits proliferation, migration, and invasion of human breast cancer cells via STAT3 inhibition
Abstract Background Signal Transducer and Activator of Transcription 3 (STAT3) is an
identified critical protein associated with the progression of cancer. Alpha mangostin (α-M), a …
identified critical protein associated with the progression of cancer. Alpha mangostin (α-M), a …
Identification of novel aurora kinase A (AURKA) inhibitors via hierarchical ligand-based virtual screening
Y Kong, A Bender, A Yan - Journal of chemical information and …, 2018 - ACS Publications
Aurora kinases are essential for cell mitosis, amplified, and overexpressed in various human
malignancies. Therefore, Aurora kinases have been promising targets for anticancer …
malignancies. Therefore, Aurora kinases have been promising targets for anticancer …
In-silico and in-vitro investigation of STAT3-PIM1 heterodimeric complex: Its mechanism and inhibition by curcumin for cancer therapeutics
The functional activity among STAT3 and PIM1, are key signaling events for cancer cell
function. Curcumin, a diarylheptanoid isolated from turmeric, effectively inhibits STAT3 …
function. Curcumin, a diarylheptanoid isolated from turmeric, effectively inhibits STAT3 …
Rational approach to identify newer caspase-1 inhibitors using pharmacophore based virtual screening, docking and molecular dynamic simulation studies
S Patel, P Modi, M Chhabria - Journal of Molecular Graphics and Modelling, 2018 - Elsevier
Caspase-1 is a key endoprotease responsible for the post-translational processing of pro-
inflammatory cytokines IL-1β, 18 & 33. Excessive secretion of IL-1β leads to numerous …
inflammatory cytokines IL-1β, 18 & 33. Excessive secretion of IL-1β leads to numerous …
Experimental and in silico insights: interaction of dimethyl sulphoxide with 1-hexyl-2-methyl imidazolium bromide/1-octyl-2-methyl imidazolium bromide at different …
I Panda, BR Behera, D Jena, SK Behera, SK Samal… - RSC …, 2024 - pubs.rsc.org
Ionic liquids have gained attention as 'designer solvents' since they offer a broad spectrum
of properties that can be tuned by altering the constituent ions. In this work, 1-alkyl-2-methyl …
of properties that can be tuned by altering the constituent ions. In this work, 1-alkyl-2-methyl …