المؤلفون: G. Leslie Burnett (1530964), Yu C. Yang (14271182), James B. Aggen (1748029), Jennifer Pitzen (1332948), Micah K. Gliedt (14271185), Chris M. Semko (2126905), Abby Marquez (14271188), James W. Evans (1360215), Gang Wang (36685), Walter S. Won (14271191), Aidan C. A. Tomlinson (14271194), Gert Kiss (1345821), Christos Tzitzilonis (275867), Arun P. Thottumkara (2677906), James Cregg (7306595), Kevin T. Mellem (1892248), Jong S. Choi (14271197), Julie C. Lee (2983218), Yongyuan Zhao (14271200), Bianca J. Lee (11216484), Justin G. Meyerowitz (14271203), John E. Knox (2523913), Jingjing Jiang (128923), Zhican Wang (2275534), David Wildes (9434006), Zhengping Wang (1434643), Mallika Singh (202117), Jacqueline A. M. Smith (14271206), Adrian L. Gill (2396434)

مصطلحات موضوعية: Biophysics, Biochemistry, Medicine, Molecular Biology, Pharmacology, Biotechnology, Developmental Biology, Cancer, Infectious Diseases, Chemical Sciences not elsewhere classified, multiple allosteric inhibitors, also preserving selectivity, also present evidence, allosteric binding sites, steric inhibitors ”, mutant cancer drivers, activated tumors hyperactivation, >< sup ><, orthosteric dual inhibitors, development candidate rmc, g12c , g12c <, steric inhibitor, mutant nsclc, many tumors, >, “ bi, selective bi, preclinical profile, preclinical model

Relation: https://figshare.com/articles/journal_contribution/Discovery_of_RMC-5552_a_Selective_Bi-Steric_Inhibitor_of_mTORC1_for_the_Treatment_of_mTORC1-Activated_Tumors/21741425

الاتاحة: https://doi.org/10.1021/acs.jmedchem.2c01658.s001

المؤلفون: G. Leslie Burnett, Yu C. Yang, James B. Aggen, Jennifer Pitzen, Micah K. Gliedt, Chris M. Semko, Abby Marquez, James W. Evans, Gang Wang, Walter S. Won, Aidan C. A. Tomlinson, Gert Kiss, Christos Tzitzilonis, Arun P. Thottumkara, James Cregg, Kevin T. Mellem, Jong S. Choi, Julie C. Lee, Yongyuan Zhao, Bianca J. Lee, Justin G. Meyerowitz, John E. Knox, Jingjing Jiang, Zhican Wang, David Wildes, Zhengping Wang, Mallika Singh, Jacqueline A. M. Smith, Adrian L. Gill

المصدر: Journal of Medicinal Chemistry. 66:149-169

مصطلحات موضوعية: Drug Discovery, Molecular Medicine

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::f4cb750ad287b7aa33c649c1e4fa24c0
https://doi.org/10.1021/acs.jmedchem.2c01658

المؤلفون: Carrie S. Tambo, Sarvind Tripathi, B. Gayani K. Perera, Dustin J. Maly, Alexander J. Bridges, Gert Kiss, Seth M. Rubin

المصدر: ACS Chem Biol
ACS chemical biology, vol 18, iss 2

مصطلحات موضوعية: Cyclin-Dependent Kinase 2, Organic Chemistry, Cyclin-Dependent Kinase 4, General Medicine, Protein Serine-Threonine Kinases, Biological Sciences, Biochemistry, Cyclin-Dependent Kinases, Article, 5.1 Pharmaceuticals, Cyclins, Chemical Sciences, CDC2-CDC28 Kinases, Molecular Medicine, Phosphorylation, Development of treatments and therapeutic interventions, Cancer

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::87712b8a44e6dd7e7c442986bb693967
https://europepmc.org/articles/PMC10029018/

المؤلفون: Mallika Singh, Abby Marquez, Carlos Stahlhut, David Wildes, Mark A. Goldsmith, Zhengping Wang, Victor Olivas, Jacqueline Smith, Collin M. Blakely, Christos Tzitzilonis, Golzar Hemmati, Caroline E. McCoach, Kasia Mordec, Adrian Liam Gill, Gert Kiss, Tientien Hsieh, Christopher J. Schulze, Trever G. Bivona, Franziska Haderk, Aubhishek Zaman, Elena S. Koltun, Jason Romero, Robert J. Nichols

المصدر: Nature cell biology

مصطلحات موضوعية: 0301 basic medicine, MAPK/ERK pathway, Protein Tyrosine Phosphatase, Non-Receptor Type 11, PTPN11, medicine.disease_cause, RMC-4550, Neoplasms, G12C, Enzyme Inhibitors, Extracellular Signal-Regulated MAP Kinases, Mice, Inbred BALB C, Mutation, Neurofibromin 1, biology, Tumor Burden, Cell biology, Phenotype, raf Kinases, Guanosine Triphosphate, KRAS, Signal transduction, SOS1 Protein, Signal Transduction, Proto-Oncogene Proteins B-raf, Mice, Nude, Antineoplastic Agents, Article, BRAF, Proto-Oncogene Proteins p21(ras), 03 medical and health sciences, Cell Line, Tumor, Biomarkers, Tumor, medicine, Animals, Humans, Genetic Predisposition to Disease, neoplasms, Mitogen-Activated Protein Kinase Kinases, Cancer, Cell Biology, medicine.disease, Xenograft Model Antitumor Assays, lung cancer, HEK293 Cells, 030104 developmental biology, NF1, biology.protein, V600E

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::54773dd67116432d3f5dfcac072a5648
https://doi.org/10.1038/s41556-018-0169-1

المؤلفون: Bianca J. Lee, Jacob A. Boyer, G. Leslie Burnett, Arun P. Thottumkara, Nidhi Tibrewal, Stacy L. Wilson, Tientien Hsieh, Abby Marquez, Edward G. Lorenzana, James W. Evans, Laura Hulea, Gert Kiss, Hui Liu, Dong Lee, Ola Larsson, Shannon McLaughlan, Ivan Topisirovic, Zhengping Wang, Zhican Wang, Yongyuan Zhao, David Wildes, James B. Aggen, Mallika Singh, Adrian L. Gill, Jacqueline A. M. Smith, Neal Rosen

المصدر: Nature Chemical Biology. 17:1209-1209

مصطلحات موضوعية: Cell Biology, Molecular Biology

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::87895925246afc37728a83e10bf0992b
https://doi.org/10.1038/s41589-021-00905-4

المؤلفون: Jacqueline Smith, Nidhi Tibrewal, Adrian Liam Gill, Gert Kiss, Abby Marquez, Ola Larsson, Ivan Topisirovic, Shannon McLaughlan, Arun P. Thottumkara, Neal Rosen, Zhican Wang, Yongyuan Zhao, Edward G. Lorenzana, Zhengping Wang, Jacob A. Boyer, Hui Liu, James Evans, Mallika Singh, Dong Lee, David Wildes, Tientien Hsieh, Bianca J. Lee, James B. Aggen, Laura Hulea, Stacy L. Wilson, G. Leslie Burnett

المصدر: Nature Chemical Biology. 17:925-925

مصطلحات موضوعية: Cell signaling, Kinase, business.industry, Cancer research, Cancer therapy, Medicine, Tumor growth, Cell Biology, mTORC1, business, Molecular Biology, Small molecule

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::0415a59994600e573fae1074c32dc8f6
https://doi.org/10.1038/s41589-021-00843-1

المؤلفون: G. Leslie Burnett, Mark A. Goldsmith, Daphne Hsieh, Pete Wildes, Jacqueline Smith, Dong Lee, Adrian Liam Gill, Gert Kiss, Frances Zhao, Nidhi Tibrewal, Zhengping Wang, Abraham I. Bassan, Ed Lorenzana, Bianca J. Lee, Abby Marquez, James B. Aggen, Stacy L. Wilson, Mallika Singh, Arun P. Thottumkara, Micah J. Gliedt, James Evans

المصدر: Molecular Cancer Research. 18:PR04-PR04

مصطلحات موضوعية: Cancer Research, biology, Chemistry, P70-S6 Kinase 1, mTORC1, mTORC2, Oncology, Cancer research, biology.protein, Phosphorylation, biological phenomena, cell phenomena, and immunity, Protein kinase A, Molecular Biology, Protein kinase B, Mechanistic target of rapamycin, PI3K/AKT/mTOR pathway

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::5e86228459b54496f952a884e874fbe6
https://doi.org/10.1158/1557-3125.pi3k-mtor18-pr04

المؤلفون: Mark A. Goldsmith, Christopher J. Schulze, Tiffany J. Choy, C. Weller, Richard Hansen, Mae Saldajeno-Concar, David Wildes, Adrian Liam Gill, Gert Kiss, Y. Yang, Denise Reyes, Cregg James Joseph, Daniel M. Whalen, Robert J. Nichols, Alun Bermingham, Steve M. Kelsey, Abby Marquez, E.S. Koltun, Mallika Singh, Jacqueline Smith, Z. Wang

المصدر: Journal of Thoracic Oncology. 15:S13-S14

مصطلحات موضوعية: Pulmonary and Respiratory Medicine, Oncology, GTP', business.industry, Cancer research, Medicine, business

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::6ed26259eb26139c4af324dcc72fdabf
https://doi.org/10.1016/j.jtho.2019.12.035

المؤلفون: Carlos L. Araya, Jason A. Reuter, William J. Greenleaf, Gert Kiss, Michael Snyder, Can Cenik, Vijay S. Pande

المصدر: Nature genetics

مصطلحات موضوعية: 0301 basic medicine, Genetics, Untranslated region, Mutation, non-coding variation, Significantly Mutated Regions (SMRs), Cancer, Improved method, Biology, medicine.disease, medicine.disease_cause, Article, DNA binding site, 03 medical and health sciences, 030104 developmental biology, Neoplasms, Spatial clustering, medicine, Humans, cancer, Identification (biology), exome sequencing, Gene

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::98b22f913092a13f4d0ec0664e6c68f3
https://doi.org/10.1038/ng.3471

المؤلفون: Mohammad M. Sultan, Gert Kiss, Vijay S. Pande

مصطلحات موضوعية: 0301 basic medicine, Protein family, General Chemical Engineering, In silico, Amino Acid Motifs, Druggability, Computational biology, Molecular Dynamics Simulation, Models, Biological, 01 natural sciences, Small Molecule Libraries, 03 medical and health sciences, Protein structure, Adenosine Triphosphate, FYN, LYN, 0103 physical sciences, Homology modeling, Src family kinase, Protein Kinase Inhibitors, Conformational ensembles, 030304 developmental biology, 0303 health sciences, Binding Sites, 010304 chemical physics, Kinase, Chemistry, General Chemistry, Markov Chains, Protein Structure, Tertiary, Kinetics, 030104 developmental biology, src-Family Kinases, Protein folding

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::d871f4acbc7be9a083686a8ba9ef91d9
https://doi.org/10.1101/228528

المؤلفون: Christos Tzitzilonis, Elena S. Koltun, Trever G. Bivona, Mallika Singh, Daphne Hsieh, Robert J. Nichols, Christopher J. Schulze, Jason Romero, Jacqueline Smith, Abby Marquez, Franziska Haderk, Kasia Mordec, Carlos Stahlhut, Adrian Liam Gill, Gert Kiss, Mark A. Goldsmith, Golzar Hemmati, David Wildes

مصطلحات موضوعية: Chemistry, Phosphatase, medicine.disease_cause, digestive system diseases, law.invention, PTPN11, chemistry.chemical_compound, law, SOS1, Cancer research, medicine, Suppressor, KRAS, Guanine nucleotide exchange factor, Growth inhibition, neoplasms, V600E

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::e89ed40580c12f3d688f34996884655b

المؤلفون: Christopher J. Schulze, Daniel M. Whalen, Adrian Liam Gill, Gert Kiss, Cregg James Joseph, Steve M. Kelsey, David Wildes, Abby Marquez, Alun Bermingham, Mae Saldajeno-Concar, Jacqueline Smith, Denise Reyes, Elena S. Koltun, Tiffany J. Choy, Robert J. Nichols, Yu C. Yang, Mallika Singh, Caroline E Weller, Mark A. Goldsmith, Richard Hansen

المصدر: Molecular Cancer Therapeutics. 18:PR10-PR10

مصطلحات موضوعية: Cancer Research, GTP', Chemistry, Cell growth, MEK inhibitor, Cell, GTPase, medicine.disease_cause, In vitro, medicine.anatomical_structure, Oncology, Cancer cell, medicine, Cancer research, KRAS

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::3973d63190eae9ef011300fcb8b05f2d
https://doi.org/10.1158/1535-7163.targ-19-pr10

المؤلفون: Gert Kiss, Nihan Çelebi-Ölçüm, Rocco Moretti, David Baker, K. N. Houk

المصدر: Angewandte Chemie. 125:5810-5836

مصطلحات موضوعية: General Medicine

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::82a3941c244a1941839712655f97158e
https://doi.org/10.1002/ange.201204077

المؤلفون: Gert Kiss, Frances H. Arnold, Sheel C. Dodani, Vijay S. Pande, Jackson K. B. Cahn, Ye Su

مصطلحات موضوعية: 0301 basic medicine, Chemistry, Stereochemistry, General Chemical Engineering, Mutagenesis (molecular biology technique), Regioselectivity, General Chemistry, 010402 general chemistry, 01 natural sciences, 0104 chemical sciences, Enzyme catalysis, Loop (topology), 03 medical and health sciences, Molecular dynamics, 030104 developmental biology, Protein structure, Protein Structural Elements, Mutation (genetic algorithm), Biological system

وصف الملف: application/pdf; application/zip

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::69aa074c5281198fd3cba76985e156dd
https://resolver.caltech.edu/CaltechAUTHORS:20160323-124510465

المؤلفون: Nihan Çelebi-Ölçüm, Gert Kiss, Mahboubeh Kheirabadi, Kendall N. Houk, Christian E. Schafmeister, Matthew F.L. Parker, Qingquan Zhao

المصدر: Journal of the American Chemical Society. 134:18345-18353

مصطلحات موضوعية: Models, Molecular, Vinyl Compounds, Esterification, Pyridines, Methanol, General Chemistry, Transesterification, Biochemistry, Catalysis, chemistry.chemical_compound, Colloid and Surface Chemistry, chemistry, Nucleophile, Biomimetic Materials, Benzyl alcohol, Alcohols, Electrophile, Pyridine, Biocatalysis, Organic chemistry, Oxyanion hole, Bifunctional

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::214c0777ad7c06078ee4b9a918da7b30
https://doi.org/10.1021/ja3069648

المؤلفون: Daniela Röthlisberger, David Baker, Kendall N. Houk, Shira Albeck, Gert Kiss, Orly Dym, Olga Khersonsky, Dan S. Tawfik

المصدر: Proceedings of the National Academy of Sciences. 109:10358-10363

مصطلحات موضوعية: Multidisciplinary, Stability (learning theory), Computational biology, Biological Sciences, Biology, Directed evolution, Enzymes, Enzyme catalysis, Evolvability, Biochemistry, Catalytic Domain, Enzyme Stability, Mutation (genetic algorithm), Enzyme kinetics, Directed Molecular Evolution, Catalytic efficiency

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::12e7672aeed9f9b706a2d614da62c5ac
https://doi.org/10.1073/pnas.1121063109

المؤلفون: Gert Kiss, Roberto A. Chica, Donald Hilvert, Stephen L. Mayo, Rebecca Blomberg, Toni M. Lee, Kendall N. Houk, Leonard M. Thomas, Heidi K. Privett

المصدر: Proceedings of the National Academy of Sciences. 109:3790-3795

مصطلحات موضوعية: Stereochemistry, Protein design, Molecular Conformation, 660.6: Biotechnologie, Crystallography, X-Ray, Ligands, Catalysis, Enzyme catalysis, Computational biology, Chemical models, Molecular dynamics, Transition state analog, Molecular dynamics simulation, Hydrolase, X-ray crystallography, Point mutation, Multidisciplinary, biology, Chemistry, Active site, Catalytic domain, Protein engineering, Biological Sciences, Lyase, Molecular cnformation, Combinatorial chemistry, Models, Chemical, biology.protein, Protons, Software, Algorithms

وصف الملف: application/pdf

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::c0b4f70a683fd85e92127f481d91f4e2
https://doi.org/10.1073/pnas.1118082108

المؤلفون: Seonah Kim, Nihan Çelebi-Ölçüm, Gert Kiss, Kendal N. Houk, Scott A. Johnson, Geoffrey R. Nosrati, Robert S. Paton

المصدر: Modeling of Molecular Properties

مصطلحات موضوعية: Molecular dynamics, biology, Computational chemistry, Chemistry, biology.protein, Active site, Computational design, Protein engineering, Catalysis

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::4c64d1de3beee9ac69a3a3636d335e63
https://doi.org/10.1002/9783527636402.ch16

المؤلفون: Andrew M. Wollacott, Kendall N. Houk, Dan S. Tawfik, Orly Dym, David Baker, Daniela Röthlisberger, Gert Kiss, Paul Murphy, Shira Albeck, Olga Khersonsky

المصدر: Journal of Molecular Biology. 407:391-412

مصطلحات موضوعية: Models, Molecular, Protein Conformation, Chemistry, Stereochemistry, In silico, Mutagenesis, Lyases, Lyase, Directed evolution, Article, Enzyme catalysis, Protein structure, Structural Biology, Catalytic Domain, Enzyme Stability, Mutation, Mutation (genetic algorithm), Thermodynamics, Computer Simulation, Directed Molecular Evolution, Molecular Biology

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b2804944066fcfbc2a1ba030f779768f
https://doi.org/10.1016/j.jmb.2011.01.041

المؤلفون: Ashutosh S. Jogalekar, Mellem Kevin, Chris M. Semko, Andreas Buckl, Elena S. Koltun, Jacqueline Smith, Naing Aay, Mallika Singh, Christos Tzitzilonis, Robert J. Nichols, Won Walter, Nidhi Tibrewal, Zhengping Wang, Kasia Mordec, Adrian Liam Gill, Gert Kiss, Abby Marquez, Susan E. Wilson, Mae Saldajeno-Concar, David Wilds

المصدر: Cancer Research. 78:4878-4878

مصطلحات موضوعية: 0301 basic medicine, Scaffold protein, 030103 biophysics, Cancer Research, Kinase, Chemistry, Allosteric regulation, Phosphatase, Protein tyrosine phosphatase, Pharmacology, 03 medical and health sciences, Oncology, Signal transduction, Receptor, ADME

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::b9799dbbd6e549ae1405a9baa4fbc959
https://doi.org/10.1158/1538-7445.am2018-4878