المؤلفون: Robert L. Hudkins, Gregory R. Ott, Arup K. Ghose

المصدر: ACS Chemical Neuroscience. 8:147-154

مصطلحات موضوعية: Central Nervous System, Scheme (programming language), Chemical Phenomena, Physiology, Cognitive Neuroscience, Druggability, Machine learning, computer.software_genre, 01 natural sciences, Biochemistry, Animals, Humans, Monitoring, Physiologic, computer.programming_language, 010405 organic chemistry, business.industry, Chemistry, Property distribution, Cell Biology, General Medicine, 0104 chemical sciences, 010404 medicinal & biomolecular chemistry, Models, Chemical, Drug Design, Artificial intelligence, business, Neuroscience, computer, Databases, Chemical, Central Nervous System Agents

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::204e25a22d91fc856c902599991a267d
https://doi.org/10.1021/acschemneuro.6b00273

المؤلفون: Nathan Anderson, Diane E. Gingrich, Arup K. Ghose, Mark S. Albom, Bruce D. Dorsey, Lisa D. Aimone, Elizabeth Bruckheimer, Jason C. Wagner, Matthew A. Curry, Lihui Lu, Jay Friedman, Mark A. Ator, Bruce Ruggeri, Eugen F. Mesaros, Mangeng Cheng, Zeqi Huang, Keith S. Learn, Matthew R. Quail, Thelma S. Angeles, Pawel Dobrzanski, Gregory R. Ott, Sandra V. Fernandez, Joseph G. Lisko, Kevin J. Wells-Knecht, Weihua Wan

المصدر: Journal of medicinal chemistry. 59(16)

مصطلحات موضوعية: 0301 basic medicine, Models, Molecular, medicine.drug_class, Administration, Oral, Mice, Nude, Mice, SCID, Metastasis, Focal adhesion, 03 medical and health sciences, Mice, Structure-Activity Relationship, 0302 clinical medicine, In vivo, hemic and lymphatic diseases, Cell Line, Tumor, Drug Discovery, medicine, Anaplastic lymphoma kinase, Animals, Humans, Anaplastic Lymphoma Kinase, Protein Kinase Inhibitors, Cell Proliferation, Dose-Response Relationship, Drug, Molecular Structure, Cell growth, Chemistry, Drug discovery, Receptor Protein-Tyrosine Kinases, Neoplasms, Experimental, medicine.disease, In vitro, ALK inhibitor, Benzocycloheptenes, 030104 developmental biology, Biochemistry, 030220 oncology & carcinogenesis, Focal Adhesion Kinase 1, Benzamides, Cancer research, Molecular Medicine, Female, Drug Screening Assays, Antitumor

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::2f38d2d8693c2496a71a1241c7558ff6
https://pubmed.ncbi.nlm.nih.gov/27527804

المؤلفون: Henry J. Breslin, Bruce D. Dorsey, Arup K. Ghose, Mangeng Cheng, Mark S. Albom, Kevin J. Wells-Knecht, Weihua Wan, Thelma S. Angeles, R. Curtis Haltiwanger, Brandon M. Lane, Gregory R. Ott

المصدر: Journal of Medicinal Chemistry. 55:449-464

مصطلحات موضوعية: Models, Molecular, Oncogene Proteins, Fusion, Stereochemistry, Molecular Conformation, Antineoplastic Agents, Heterocyclic Compounds, 4 or More Rings, Structure-Activity Relationship, chemistry.chemical_compound, hemic and lymphatic diseases, Drug Discovery, Humans, Anaplastic lymphoma kinase, Anaplastic Lymphoma Kinase, Phosphorylation, IC50, chemistry.chemical_classification, biology, Kinase, Nuclear Proteins, Receptor Protein-Tyrosine Kinases, Combinatorial chemistry, Receptor, Insulin, In vitro, Insulin receptor, Enzyme, Diaminopyrimidine, chemistry, Drug Design, biology.protein, Molecular Medicine, Selectivity, Nucleophosmin

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4dd41a7bcedd19c22f3624560d147f49
https://doi.org/10.1021/jm201333e

المؤلفون: Robert L. Hudkins, Bruce D. Dorsey, Torsten Herbertz, John P. Mallamo, Arup K. Ghose

المصدر: ACS Chemical Neuroscience

مصطلحات موضوعية: Drug, Physiology, Research areas, Cognitive Neuroscience, media_common.quotation_subject, Central nervous system, Disease, chemoinformatics, Biochemistry, Brain cancer, chemical substructures, Medicine, solvent accessible surface area, media_common, molecular volume, Drug discovery, business.industry, non-CNS drugs, Cell Biology, General Medicine, physicochemical property profile, aliphatic amine, medicine.anatomical_structure, linear chains, Aliphatic amine, polar hydrogen, CNS, polar surface area, business, CNS drugs, Neuroscience, Research Article

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::9082302be26311a31e107b9e1fc8d1ef
https://doi.org/10.1021/cn200100h

المؤلفون: Mark S. Albom, Bruce D. Dorsey, Joseph G. Lisko, Mangeng Cheng, Bruce Ruggeri, Arup K. Ghose, Eugen F. Mesaros, Weihua Wan, Mark A. Ator, Matthew R. Quail, Zeqi Huang, Diane E. Gingrich, Tho V. Thieu, Gregory J. Wells, Thelma S. Angeles, Gregory R. Ott, Lisa D. Aimone, Lihui Lu

المصدر: Journal of Medicinal Chemistry. 54:6328-6341

مصطلحات موضوعية: Models, Molecular, Cell Membrane Permeability, Transplantation, Heterologous, Antineoplastic Agents, Mice, SCID, In Vitro Techniques, Rats, Sprague-Dawley, Mice, Structure-Activity Relationship, chemistry.chemical_compound, In vivo, Cell Line, Tumor, hemic and lymphatic diseases, Drug Discovery, medicine, Animals, Humans, Anaplastic lymphoma kinase, Structure–activity relationship, Anaplastic Lymphoma Kinase, Pyrroles, Anaplastic large-cell lymphoma, Triazine, Sulfonamides, Triazines, Chemistry, Kinase, Receptor Protein-Tyrosine Kinases, Bridged Bicyclo Compounds, Heterocyclic, medicine.disease, Rats, Transplantation, Diaminopyrimidine, Biochemistry, Microsomes, Liver, Lymphoma, Large-Cell, Anaplastic, Molecular Medicine, Drug Screening Assays, Antitumor, Neoplasm Transplantation

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::4ff1dc2c02c706eed915e53603283891
https://doi.org/10.1021/jm200758k

المؤلفون: Linda Weinberg, Ted L. Underiner, Mark S. Albom, Craig A. Zificsak, Arup K. Ghose, Renee C. Roemmele, Mangeng Cheng, Karen L. Milkiewicz, Jay P. Theroff, Bruce D. Dorsey, Thelma S. Angeles

المصدر: Bioorganic & Medicinal Chemistry. 18:4351-4362

مصطلحات موضوعية: Clinical Biochemistry, Cell, Pharmaceutical Science, Antineoplastic Agents, Biochemistry, Chemical synthesis, Structure-Activity Relationship, hemic and lymphatic diseases, Drug Discovery, medicine, Anaplastic lymphoma kinase, Anaplastic Lymphoma Kinase, Computer Simulation, Protein Kinase Inhibitors, Molecular Biology, chemistry.chemical_classification, Binding Sites, Chemistry, Kinase, Organic Chemistry, Receptor Protein-Tyrosine Kinases, Protein-Tyrosine Kinases, In vitro, medicine.anatomical_structure, Enzyme, Cell culture, Pyrazines, Molecular Medicine, Signal transduction

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::b1bddc45e141f6cd00dccf8a2e98b12a
https://doi.org/10.1016/j.bmc.2010.04.087

المؤلفون: Douglas A. Pippin, Torsten Herbertz, Joseph M. Salvino, Arup K. Ghose, John P. Mallamo

المصدر: Journal of Medicinal Chemistry. 51:5149-5171

مصطلحات موضوعية: Drug, media_common.quotation_subject, Quantitative Structure-Activity Relationship, Pharmacology, Ligands, chemistry.chemical_compound, Drug Discovery, medicine, Humans, Databases, Protein, Benzamide, Phosphorylase kinase, Protein Kinase Inhibitors, media_common, Binding Sites, biology, Chemistry, Drug discovery, Kinase, Imatinib, Biochemistry, Drug Design, Mitogen-activated protein kinase, biology.protein, Molecular Medicine, Signal transduction, medicine.drug

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::3cfdacb02a80ba9f72c931b97abe0190
https://doi.org/10.1021/jm800475y

المؤلفون: Joseph M. Salvino, Torsten Herbertz, Arup K. Ghose, John P. Mallamo

المصدر: Drug Discovery Today. 11:1107-1114

مصطلحات موضوعية: Pharmacology, Drug Industry, Molecular Structure, business.industry, Computer science, Drug discovery, Knowledge Bases, Nanotechnology, Computational biology, Pharmaceutical Preparations, Knowledge base, Pharmaceutical technology, Cheminformatics, Drug Design, Drug Discovery, Humans, business, Medical Informatics

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::8df02ee864149156a10a6701abfd655a
https://doi.org/10.1016/j.drudis.2006.10.012

المؤلفون: Arup K. Ghose, Vellarkad N. Viswanadhan, John J. Wendoloski

المصدر: Journal of Receptors and Signal Transduction. 21:357-375

مصطلحات موضوعية: Binding Sites, Models, Chemical, Chemistry, Drug Design, Combinatorial Chemistry Techniques, Quantitative Structure-Activity Relationship, Cell Biology, Pharmacophore, Molecular Biology, Biochemistry, Combinatorial chemistry, Protein Binding

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_dedup___::5ba17614e626928c6e12c4c198b4569e
https://doi.org/10.1081/rrs-100107923

المؤلفون: John J. Wendoloski, Vellarkad N. Viswanadhan, Arup K. Ghose

المصدر: Perspectives in Drug Discovery and Design. 19:85-98

مصطلحات موضوعية: Pharmacology, Partition coefficient, Aqueous solution, Group (periodic table), Computational chemistry, Chemistry, Organic Chemistry, Drug Discovery, Lipophilicity, Partial least squares regression, Atom, Solvation, Molecule

URL الوصول: https://explore.openaire.eu/search/publication?articleId=doi_________::6ba5c9c9af121c886bf2e300bd0b0bfa
https://doi.org/10.1023/a:1008767505932