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Nature, ISSN 0028-0836, 06/2018, Volume 558, Issue 7710, pp. E1 - E1
In the originally published version of this Letter, the authors Arthur F. Kluge, Michael A. Patane and Ce Wang were inadvertently omitted from the author list.... 
Journal Article
Journal of Chemical Information and Modeling, ISSN 1549-9596, 03/2008, Volume 48, Issue 3, pp. 646 - 658
A new method for analyzing a structure−activity relationship is proposed. By use of a simple quantitative index, one can readily identify “structure−activity... 
HUMAN MELANOCORTIN-4 RECEPTOR | POTENT | CHEMISTRY, MEDICINAL | COMPUTER SCIENCE, INTERDISCIPLINARY APPLICATIONS | SAR | COMPUTER SCIENCE, INFORMATION SYSTEMS | ANTAGONISTS | DIHYDROQUINOLINE | AGONISTS | CHEMISTRY, MULTIDISCIPLINARY | DISCOVERY
Journal Article
Wiley Interdisciplinary Reviews: Computational Molecular Science, ISSN 1759-0876, 09/2013, Volume 3, Issue 5, pp. 449 - 464
Journal Article
2011, Introduction to Cheminformatics : data management, manipulation and properties
Web Resource
Nature, ISSN 0028-0836, 10/2017, Volume 550, Issue 7674, pp. 128 - 132
The dynamic and reversible acetylation of proteins, catalysed by histone acetyltransferases (HATs) and histone deacetylases (HDACs), is a major epigenetic... 
ANDROGEN RECEPTOR | ACETYLATION | MULTIDISCIPLINARY SCIENCES | PROSTATE-CANCER | ACETYLTRANSFERASES P300 | EXPRESSION | SMALL-MOLECULE INHIBITOR | Catalytic Domain - drug effects | p300-CBP Transcription Factors - antagonists & inhibitors | Prostatic Neoplasms, Castration-Resistant - enzymology | Histone Acetyltransferases - chemistry | Humans | Receptors, Androgen - metabolism | Crystallography, X-Ray | Male | Antineoplastic Agents - therapeutic use | Hematologic Neoplasms - enzymology | Hematologic Neoplasms - pathology | Cell Lineage - drug effects | Heterocyclic Compounds, 4 or More Rings - pharmacology | Prostatic Neoplasms, Castration-Resistant - pathology | Heterocyclic Compounds, 4 or More Rings - therapeutic use | Biocatalysis - drug effects | Histone Acetyltransferases - metabolism | Antineoplastic Agents - pharmacology | Gene Expression Regulation, Neoplastic - drug effects | p300-CBP Transcription Factors - chemistry | Binding, Competitive | Enzyme Inhibitors - pharmacology | Heterocyclic Compounds, 4 or More Rings - chemistry | Models, Molecular | Neoplasms - enzymology | Prostatic Neoplasms, Castration-Resistant - drug therapy | Antineoplastic Agents - chemistry | Mice, SCID | Enzyme Inhibitors - therapeutic use | Acetyl Coenzyme A - metabolism | Neoplasms - drug therapy | Xenograft Model Antitumor Assays | p300-CBP Transcription Factors - metabolism | Animals | Histone Acetyltransferases - antagonists & inhibitors | Cell Line, Tumor | Hematologic Neoplasms - drug therapy | Protein Conformation | Cell Proliferation - drug effects | Mice | Neoplasms - pathology | Care and treatment | Chemical inhibitors | Usage | Transferases | Binding proteins | Health aspects | Tumors | Histone deacetylase | Transcription factors | Molecular structure | Transcription | Peptides | Androgen receptors | Amino acids | Event-related potentials | Selectivity | Catalytic activity | Kinases | Experiments | Crystallography | Proteins | CREB-binding protein | Castration | Xenografts | Coenzyme A | Acetylation | Catalysis | Inhibition | Crystal structure | Hematology | Feasibility studies | Cyclic AMP response element-binding protein | Histone acetyltransferase | Inhibitors | Microscopy | Natural products | Regulatory mechanisms (biology) | Epigenetics | Ligands | Prostate cancer | Prostate | Cancer | INORGANIC, ORGANIC, PHYSICAL, AND ANALYTICAL CHEMISTRY
Journal Article
Current Pharmaceutical Design, ISSN 1381-6128, 2003, Volume 9, Issue 20, pp. 1649 - 1664
Pharmacophore discovery is one of the major elements of molecular modeling in the. absence of X-ray structural data. While pharmacophores initially made their... 
DESIGN | SHAPE | RECOGNITION | FIELD | PERFORMANCE | CNS | PHARMACOLOGY & PHARMACY | AGENTS | INHIBITORS | ANTAGONISTS | TOOL | Models, Molecular | Combinatorial Chemistry Techniques | Molecular Conformation | Quantitative Structure-Activity Relationship | Drug Design
Journal Article
Internet Electronic Journal of Molecular Design, 09/2007, Volume 6, Issue 9, pp. 271 - 279
Journal Article
Journal of Chemical Information and Modeling, ISSN 1549-9596, 08/2008, Volume 48, Issue 8, pp. 1716 - 1728
Journal Article
Drug Discovery Today, ISSN 1359-6446, 2009, Volume 14, Issue 13, pp. 698 - 705
The problem of how to explore structure–activity relationships (SARs) systematically is still largely unsolved in medicinal chemistry. Recently, data analysis... 
ACTIVITY CLIFFS | SAR | QSAR | PHARMACOLOGY & PHARMACY | INDEX | DIHYDROQUINOLINE | DISCOVERY | Structure-Activity Relationship | Animals | Chemistry, Pharmaceutical - methods | Models, Chemical | Humans | Pharmaceutical Preparations - chemistry
Journal Article
Drug Discovery Today: Technologies, ISSN 1740-6749, 2010, Volume 7, Issue 4, pp. e255 - e262
The history of the evolution of the methodology to search 3D databases using pharmacophores is recounted, starting with the work of Kier 1968–1971, where he... 
Journal Article
Internet Electronic Journal of Molecular Design, 2012, Volume 11, Issue 1, pp. 271 - 279
Journal Article
Chinese Journal of Cancer, ISSN 1000-467X, 2011, Volume 30, Issue 2, pp. 124 - 137
Journal Article
Wiley Interdisciplinary Reviews: Computational Molecular Science, ISSN 1759-0876, 09/2013, Volume 3, Issue 5, pp. 449 - 464
Different approaches to the generation of pharmacophore models—pharmaco‐phore discovery—are compared, and analyzed in detail at the level of their conceptual... 
DESIGN | RECOGNITION | ALIGNMENT | PROTEIN-BOUND LIGANDS | DRUG DISCOVERY | MATHEMATICAL & COMPUTATIONAL BIOLOGY | HOT-SPOTS | IDENTIFICATION | BINDING | CHEMISTRY, MULTIDISCIPLINARY | CONFORMATIONS | Foundations | Pharmacology
Journal Article
Nature, ISSN 0028-0836, 10/2017, Volume 550, Issue 7674, pp. 128 - 132
The dynamic and reversible acetylation of proteins catalyzed by histone acetyltransferases (HATs) and histone deacetylases (HDACs) is a major epigenetic... 
CBP | EP300 | prostate cancer | androgen receptor | histone acetyltransferase | H3K27Ac
Journal Article
ACS Medicinal Chemistry Letters, ISSN 1948-5875, 01/2018, Volume 9, Issue 1, pp. 28 - 33
p300 and its paralog CBP can acetylate histones and other proteins and have been implicated in a number of diseases characterized by aberrant gene activation,... 
CBP | p300 | histone acetyl transferase | CHEMISTRY, MEDICINAL | PROTEIN | STRUCTURAL BASIS | ACETYLATION | TARGETS | CITRATE SYNTHASE | BINDING | SMALL-MOLECULE INHIBITOR
Journal Article
癌症, ISSN 1000-467X, 2011, Volume 30, Issue 2, pp. 124 - 137
Proteins fold into their functional 3-dimensional structures from a linear amino acid sequence. In vitro this process is spontaneous; while in vivo it is... 
蛋白质平衡 | 癌症 | 化疗药物 | 氨基酸序列 | 蛋白合成 | 细胞 | 三维结构 | 蛋白质折叠
Journal Article
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