Novel Inhibitors of Androgen Receptor's DNA Binding Domain Identified Using an Ultra-Large Virtual Screening.
Sign Up to like & getrecommendations! Published in 2023 at "Molecular informatics"
DOI: 10.1002/minf.202300026
Abstract: Androgen receptor (AR) inhibition remains the primary strategy to combat the progression of prostate cancer (PC). However, all clinically used AR inhibitors target the ligand-binding domain (LBD), which is highly susceptible to truncations through splicing… read more here.
Keywords: novel inhibitors; virtual screening; androgen receptor; ultra large ... See more keywords
Novel Method for the Purification of House Dust Mite Allergen Der p 1 and Its Use in Structure-Based Chemical Design of Novel Inhibitors.
Sign Up to like & getrecommendations! Published in 2019 at "Methods in molecular biology"
DOI: 10.1007/978-1-4939-9591-2_14
Abstract: House dust mites are globally significant triggers of allergic disease. Notable among their extensive repertoire of allergens are the Group 1 cysteine peptidase allergens which function as digestive enzymes in house dust mites. Compelling evidence… read more here.
Keywords: house dust; method purification; novel inhibitors; der use ... See more keywords
Novel inhibitors of lysine (K)-specific Demethylase 4A with anticancer activity
Sign Up to like & getrecommendations! Published in 2017 at "Investigational New Drugs"
DOI: 10.1007/s10637-017-0496-2
Abstract: SummaryLysine (K)-specific demethylase 4A (KDM4A) is a histone demethylase that removes methyl residues from trimethylated or dimethylated histone 3 at lysines 9 and 36. Overexpression of KDM4A is found in various cancer types. To identify… read more here.
Keywords: demethylase; ldd2269; kdm4a; novel inhibitors ... See more keywords
Discovery of novel inhibitors of human galactokinase by virtual screening
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Computer-Aided Molecular Design"
DOI: 10.1007/s10822-019-00190-3
Abstract: Classic Galactosemia is a potentially lethal autosomal recessive metabolic disorder caused by deficient galactose-1-phosphate uridyltransferase (GALT) that results in the buildup of galactose-1-phosphate (gal-1-p) in cells. Galactokinase (GALK1) is the enzyme responsible for converting galactose… read more here.
Keywords: virtual screening; inhibitors human; discovery novel; novel inhibitors ... See more keywords
Screening for novel inhibitors of glutathione peroxidase
Sign Up to like & getrecommendations! Published in 2018 at "Free Radical Biology and Medicine"
DOI: 10.1016/j.freeradbiomed.2018.04.152
Abstract: Cancer cells have higher basal levels of reactive oxygen species (ROS) production, and altered expression of antioxidant enzymes, when compared to normal cells. At high levels, ROS can cause substantial cellular damage, often leading to… read more here.
Keywords: inhibitors glutathione; glutathione peroxidase; novel inhibitors; screening novel ... See more keywords
Structure-based virtual screening, free energy of binding and molecular dynamics simulations to propose novel inhibitors of Mtb-MurB oxidoreductase enzyme
Sign Up to like & getrecommendations! Published in 2020 at "Journal of Biomolecular Structure and Dynamics"
DOI: 10.1080/07391102.2020.1712258
Abstract: Abstract Currently, the growing incidence of drug resistance toward tuberculosis intensified the need for discovery of novel targets and their inhibitors. The enzyme MurB which is involved in one of the steps for peptidoglycan biosynthesis… read more here.
Keywords: virtual screening; based virtual; energy; structure based ... See more keywords
Novel inhibitors of the STAT3 signaling pathway: an updated patent review (2014-present).
Sign Up to like & getrecommendations! Published in 2022 at "Expert opinion on therapeutic patents"
DOI: 10.1080/13543776.2022.2056013
Abstract: INTRODUCTION STAT3 is a critical transcription factor that transmits signals from the cell surface to the nucleus, thus influencing the transcriptional regulation of some oncogenes. The inhibition of the activation of STAT3 is considered a… read more here.
Keywords: review; stat3 inhibitors; stat3 signaling; signaling pathway ... See more keywords
Abstract 1017: Novel inhibitors of AR-v7 nuclear import: new therapeutic opportunities for CRPC
Sign Up to like & getrecommendations! Published in 2019 at "Endocrinology"
DOI: 10.1158/1538-7445.am2019-1017
Abstract: Reactivation of androgen receptor (AR) signaling by active splice variants (AR-Vs) is one of key drivers of castration resistant prostate cancer (CRPC). AR-v7 is the most prevalent AR-V and its expression has been clinically associated… read more here.
Keywords: import new; import; inhibitors nuclear; nuclear import ... See more keywords
Discovery of Novel Inhibitors of LpxC Displaying Potent In Vitro Activity against Gram-Negative Bacteria.
Sign Up to like & getrecommendations! Published in 2019 at "Journal of Medicinal Chemistry"
DOI: 10.2210/pdb6i49/pdb
Abstract: UDP-3-O-((R)-3-hydroxymyristoyl)-N-glucosamine deacetylase (LpxC) is as an attractive target for the discovery and development of novel antibacterial drugs to address the critical medical need created by multidrug resistant Gram-negative bacteria. By using a scaffold hopping approach… read more here.
Keywords: discovery novel; discovery; gram negative; negative bacteria ... See more keywords
Novel Inhibitors and Activity-Based Probes Targeting Trypsin-Like Serine Proteases
Sign Up to like & getrecommendations! Published in 2022 at "Frontiers in Chemistry"
DOI: 10.3389/fchem.2022.782608
Abstract: The trypsin-like proteases (TLPs) play widespread and diverse roles, in a host of physiological and pathological processes including clot dissolution, extracellular matrix remodelling, infection, angiogenesis, wound healing and tumour invasion/metastasis. Moreover, these enzymes are involved… read more here.
Keywords: novel inhibitors; inhibitors activity; activity; activity based ... See more keywords
Identification of novel inhibitors against hantaviruses through 2D fingerprinting and molecular modeling approaches
Sign Up to like & getrecommendations! Published in 2023 at "Frontiers in Immunology"
DOI: 10.3389/fimmu.2023.1113321
Abstract: With the immensely growing outbreaks of hantavirus with still no effective treatment available, there is an urgent need of exploring new computational approaches which will target potential virulent proteins that will eventually reduce its growth.… read more here.
Keywords: compound; inhibitors hantaviruses; novel inhibitors; kcal mol ... See more keywords