相关参考文献
注意：仅列出部分参考文献，下载原文获取全部文献信息。Cryo-EM Structure of the Human Cannabinoid Receptor CB2-Gi Signaling Complex
Changrui Xing et al.
CELL (2020)
Virtual discovery of melatonin receptor ligands to modulate circadian rhythms
Reed M. Stein et al.
NATURE (2020)
Impact of GPCR Structures on Drug Discovery
Miles Congreve et al.
CELL (2020)
An open-source drug discovery platform enables ultra-large virtual screens
Christoph Gorgulla et al.
NATURE (2020)
Generating Multibillion Chemical Space of Readily Accessible Screening Compounds
Oleksandr O. Grygorenko et al.
ISCIENCE (2020)
Ultra-large library docking for discovering new chemotypes
Jiankun Lyu et al.
NATURE (2019)
One-Pot Parallel Synthesis of 5-(Dialkylamino)tetrazoles
Olena Savych et al.
ACS COMBINATORIAL SCIENCE (2019)
Crystal Structure of the Human Cannabinoid Receptor CB2
Xiaoting Li et al.
CELL (2019)
Cryo-EM in drug discovery: achievements, limitations and prospects
Jean-Paul Renaud et al.
NATURE REVIEWS DRUG DISCOVERY (2018)
Structure-Based Discovery of New Antagonist and Biased Agonist Chemotypes for the Kappa Opioid Receptor
Zhong Zheng et al.
JOURNAL OF MEDICINAL CHEMISTRY (2017)
Editorial: The CB2 Cannabinoid System: A New Strategy in Neurodegenerative Disorder and Neuroinflammation
Marialessandra Contino et al.
FRONTIERS IN NEUROSCIENCE (2017)
Novel Insights into the Roles of Rho Kinase in Cancer
Lei Wei et al.
ARCHIVUM IMMUNOLOGIAE ET THERAPIAE EXPERIMENTALIS (2016)
Docking Screens for Novel Ligands Conferring New Biology
John J. Irwin et al.
JOURNAL OF MEDICINAL CHEMISTRY (2016)
Rho-associated kinase signalling and the cancer microenvironment: novel biological implications and therapeutic opportunities
Venessa T. Chin et al.
EXPERT REVIEWS IN MOLECULAR MEDICINE (2015)
PRESTO-Tango as an open-source resource for interrogation of the druggable human GPCRome
Wesley K. Kroeze et al.
NATURE STRUCTURAL & MOLECULAR BIOLOGY (2015)
PRESTO-Tango as an open-source resource for interrogation of the druggable human GPCRome
Wesley K. Kroeze et al.
NATURE STRUCTURAL & MOLECULAR BIOLOGY (2015)
Probing the Carboxyester Side Chain in Controlled Deactivation (-)-Δ8-Tetrahydrocannabinols
Spyros P. Nikas et al.
JOURNAL OF MEDICINAL CHEMISTRY (2015)
A One-Pot Parallel Reductive Amination of Aldehydes with Heteroaromatic Amines
Andrey V. Bogolubsky et al.
ACS COMBINATORIAL SCIENCE (2014)
Structure-Function of the G Protein-Coupled Receptor Superfamily
Vsevolod Katritch et al.
ANNUAL REVIEW OF PHARMACOLOGY AND TOXICOLOGY, VOL 53, 2013 (2013)
Fragment-based lead discovery grows up
Monya Baker
NATURE REVIEWS DRUG DISCOVERY (2013)
Ligand and Decoy Sets for Docking to G Protein-Coupled Receptors
Edgar A. Gatica et al.
JOURNAL OF CHEMICAL INFORMATION AND MODELING (2012)
ChEMBL: a large-scale bioactivity database for drug discovery
Anna Gaulton et al.
NUCLEIC ACIDS RESEARCH (2012)
Structure-based drug screening for G-protein-coupled receptors
Brian K. Shoichet et al.
TRENDS IN PHARMACOLOGICAL SCIENCES (2012)
Crystal Structure-Based Virtual Screening for Fragment-like Ligands of the Human Histamine H1 Receptor
Chris de Graaf et al.
JOURNAL OF MEDICINAL CHEMISTRY (2011)
Comprehensive assay of kinase catalytic activity reveals features of kinase inhibitor selectivity
Theonie Anastassiadis et al.
NATURE BIOTECHNOLOGY (2011)
Structure-Based Discovery of Novel Chemotypes for Adenosine A2A Receptor Antagonists
Vsevolod Katritch et al.
JOURNAL OF MEDICINAL CHEMISTRY (2010)
Novel 1′,1′-Chain Substituted Hexahydrocannabinols: 9/β-1-Hydroxy-3-(1-hexyl-cyclobut-l-yl)hexahydrocannabinol (AM2389) a Highly Potent Cannabinoid Receptor 1 (CB1) Agonist
Spyros P. Nikas et al.
JOURNAL OF MEDICINAL CHEMISTRY (2010)
New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays
Jonathan B. Baell et al.
JOURNAL OF MEDICINAL CHEMISTRY (2010)
Structure-Based Virtual Ligand Screening: Recent Success Stories
Bruno O. Villoutreix et al.
COMBINATORIAL CHEMISTRY & HIGH THROUGHPUT SCREENING (2009)
Recent progress in fragment-based lead discovery
Michele N. Schulz et al.
CURRENT OPINION IN PHARMACOLOGY (2009)
Four-Dimensional Docking: A Fast and Accurate Account of Discrete Receptor Flexibility in Ligand Docking
Giovanni Bottegoni et al.
JOURNAL OF MEDICINAL CHEMISTRY (2009)
Molecular docking and ligand specificity in fragment-based inhibitor discovery
Yu Chen et al.
NATURE CHEMICAL BIOLOGY (2009)
Biology and therapeutic potential of cannabinoid CB2 receptor inverse agonists
C. A. Lunn et al.
BRITISH JOURNAL OF PHARMACOLOGY (2008)
The structure of dimeric ROCK I reveals the mechanism for ligand selectivity
M Jacobs et al.
JOURNAL OF BIOLOGICAL CHEMISTRY (2006)
Cheminformatics analysis of organic substituents: identification of the most common substituents, calculation of substituent properties, and automatic identification of drug-like bioisosteric groups
P Ertl
JOURNAL OF CHEMICAL INFORMATION AND COMPUTER SCIENCES (2003)
High-throughput docking for lead generation
R Abagyan et al.
CURRENT OPINION IN CHEMICAL BIOLOGY (2001)
分享论文
