Zobrazeno 1 - 10
of 12
pro vyhledávání: '"Kara J. Cutrona"'
Autor:
Sean P. Henry, Maria-Elena Liosi, Joseph A. Ippolito, Kara J. Cutrona, Stefan G. Krimmer, Ana S. Newton, Joseph Schlessinger, William L. Jorgensen
Publikováno v:
ACS Med Chem Lett
[Image: see text] The Janus kinase 2 (JAK2) pseudokinase domain (JH2) is an ATP-binding domain that regulates the activity of the catalytic tyrosine kinase domain (JH1). Dysregulation of JAK2 JH1 signaling caused by the V617F mutation in JH2 is impli
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::a2a2477b4edebc570513fb94f2dc0c2c
https://doi.org/10.1021/acsmedchemlett.2c00051
https://doi.org/10.1021/acsmedchemlett.2c00051
Autor:
Maria-Elena Liosi, Joseph A. Ippolito, Sean P. Henry, Stefan G. Krimmer, Ana S. Newton, Kara J. Cutrona, Rene A. Olivarez, Jyotidarsini Mohanty, Joseph Schlessinger, William L. Jorgensen
Publikováno v:
J Med Chem
JAK2 is a non-receptor tyrosine kinase that regulates hematopoiesis through the JAK-STAT pathway. The pseudokinase domain (JH2) is an important regulator of the activity of the kinase domain (JH1). V617F mutation in JH2 has been associated with the p
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::bcd684b9cfa095978eecbe7070dc39fa
https://europepmc.org/articles/PMC9939005/
https://europepmc.org/articles/PMC9939005/
Autor:
Shengyan Jin, José A. Cisneros, Karen S. Anderson, Krasimir A. Spasov, Kara J. Cutrona, M. Valhondo, Haichan Niu, Nicole Bertoletti, Zachary J Carter, William L. Jorgensen, Joseph A. Ippolito
Publikováno v:
ACS Med Chem Lett
[Image: see text] Covalent inhibitors of wild-type HIV-1 reverse transcriptase (CRTIs) are reported. Three compounds derived from catechol diether non-nucleoside inhibitors (NNRTIs) with addition of a fluorosulfate warhead are demonstrated to covalen
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::55d8109a7c1ef919b71f4382d6ddf24c
https://doi.org/10.1021/acsmedchemlett.0c00612
https://doi.org/10.1021/acsmedchemlett.0c00612
Publikováno v:
J Am Chem Soc
Analogs of the conformationally dynamic Claritin(®) (loratadine) and Clarinex(®) (desloratadine) scaffolds have been enantio- and chemoselectively N-oxidized using an aspartic acid containing peptide catalyst to afford stable, helically chiral prod
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c01367e1a9cf2858559dec94af3c107d
https://doi.org/10.1021/jacs.0c03904
https://doi.org/10.1021/jacs.0c03904
Publikováno v:
J Chem Inf Model
With standard scoring methods, top-ranked compounds from virtual screening by docking often turn out to be inactive. For this reason, Metadynamics, a method used for sampling rare events, was studied to further evaluate docking poses with the aim of
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2abe23c995ba42ff2b8ec903632889a6
https://europepmc.org/articles/PMC7927942/
https://europepmc.org/articles/PMC7927942/
Autor:
Thomas K. Dawson, S.G. Krimmer, Maria-Elena Liosi, Kara J. Cutrona, Ana S. Newton, David E. Puleo, Joseph Schlessinger, Yoshihisa Suzuki, William L. Jorgensen
Publikováno v:
J Med Chem
Janus kinases (JAKs) are non-receptor tyrosine kinases that are essential components of the JAK-STAT signaling pathway. Associated aberrant signaling is responsible for many forms of cancer and disorders of the immune system. The present focus is on
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4147c54acb04879d3ac21b985bb19a75
https://europepmc.org/articles/PMC7949251/
https://europepmc.org/articles/PMC7949251/
Autor:
José A. Cisneros, Joseph Schlessinger, Kara J. Cutrona, Luca Deiana, William L. Jorgensen, David E. Puleo, Ana S. Newton
Publikováno v:
ACS Medicinal Chemistry Letters. 8:614-617
A competitive fluorescence polarization (FP) assay is reported for determining binding affinities of probe molecules with the pseudokinase JAK2 JH2 allosteric site. The syntheses of the fluorescent 5 and 6 used in the assay are reported as well as Kd
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::90d96713a7e4bb7cc07181bcbe4e03b1
https://doi.org/10.1021/acsmedchemlett.7b00154
https://doi.org/10.1021/acsmedchemlett.7b00154
Role of arginine and lysine in the antimicrobial mechanism of histone-derived antimicrobial peptides
Publikováno v:
FEBS Letters. 589:3915-3920
Translocation of cell-penetrating peptides is often promoted by increased content of arginine or other guanidinum groups. However, relatively little research has considered the role of these functional groups on antimicrobial peptide activity. This s
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b1a07dc7809c84157b41d485e93954a1
https://doi.org/10.1016/j.febslet.2015.11.002
https://doi.org/10.1016/j.febslet.2015.11.002
Autor:
Sukin Sim, Mala L. Radhakrishnan, Penny Wang, Kara J. Cutrona, Brittany Beyer, Donald E. Elmore
Publikováno v:
FEBS letters. 591(5)
While many antimicrobial peptides (AMPs) disrupt bacterial membranes, some translocate into bacteria and interfere with intracellular processes. Buforin II and DesHDAP1 are thought to kill bacteria by interacting with nucleic acids. Here, molecular m
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::0ca2e5b02c7d90b7d1cbe592d3ef4d28
https://pubmed.ncbi.nlm.nih.gov/28130840
https://pubmed.ncbi.nlm.nih.gov/28130840
Publikováno v:
Journal of chemical theory and computation. 11(9)
Partial atomic charges for neutral molecules from quantum mechanical calculations are typically scaled for use in molecular modeling of liquid-phase systems. Optimal scale factors of 1.14 for CM1A and 1.27 for CM5 charges were previously determined f
Externí odkaz:
https://explore.openaire.eu/search/publication?articleId=doi_dedup___::83cb4e7d687a49454cc373bfe2df8367
https://pubmed.ncbi.nlm.nih.gov/26575922
https://pubmed.ncbi.nlm.nih.gov/26575922