Identification of Dipeptidyl Peptidase IV Inhibitors: Virtual Screening, Synthesis and Biological Evaluation
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Yuan Zhang | Huibin Zhang | Jinpei Zhou | Junhao Xing | Qing Li | Leilei Zhao | Shengping Zhang | Haomiao Liu | Haibo Cheng
[1] E. Sugaru,et al. Discovery of 3H-imidazo[4,5-c]quinolin-4(5H)-ones as potent and selective dipeptidyl peptidase IV (DPP-4) inhibitors: use of a carboxylate prodrug to improve bioavailability. , 2015, Bioorganic & medicinal chemistry.
[2] Duane D. Miller,et al. Targeting the hydrophobic pocket of autotaxin with virtual screening of inhibitors identifies a common aromatic sulfonamide structural motif , 2014, The FEBS journal.
[3] Yueqing Gu,et al. Pharmacophore Modeling and Virtual Screening for the Discovery of New type 4 cAMP Phosphodiesterase (PDE4) Inhibitors , 2013, PloS one.
[4] A Lavecchia,et al. Virtual screening strategies in drug discovery: a critical review. , 2013, Current medicinal chemistry.
[5] S. Genheden,et al. Comparison of MM/GBSA calculations based on explicit and implicit solvent simulations. , 2013, Physical chemistry chemical physics : PCCP.
[6] Woody Sherman,et al. Protein and ligand preparation: parameters, protocols, and influence on virtual screening enrichments , 2013, Journal of Computer-Aided Molecular Design.
[7] Douglas R. Houston,et al. Consensus Docking: Improving the Reliability of Docking in a Virtual Screening Context , 2013, J. Chem. Inf. Model..
[8] H. Fujii,et al. Novel series of 3-amino-N-(4-aryl-1,1-dioxothian-4-yl)butanamides as potent and selective dipeptidyl peptidase IV inhibitors. , 2012, Bioorganic & medicinal chemistry letters.
[9] Tomonori Kobayashi,et al. Discovery of 3H-imidazo[4,5-c]quinolin-4(5H)-ones as potent and selective dipeptidyl peptidase IV (DPP-4) inhibitors. , 2012, Bioorganic & medicinal chemistry.
[10] H. Utsumi,et al. Discovery and preclinical profile of teneligliptin (3-[(2S,4S)-4-[4-(3-methyl-1-phenyl-1H-pyrazol-5-yl)piperazin-1-yl]pyrrolidin-2-ylcarbonyl]thiazolidine): a highly potent, selective, long-lasting and orally active dipeptidyl peptidase IV inhibitor for the treatment of type 2 diabetes. , 2012, Bioorganic & medicinal chemistry.
[11] Hongjian Xu,et al. Novel pyrrolopyrimidine analogues as potent dipeptidyl peptidase IV inhibitors based on pharmacokinetic property-driven optimization. , 2012, European journal of medicinal chemistry.
[12] Ryan G. Coleman,et al. ZINC: A Free Tool to Discover Chemistry for Biology , 2012, J. Chem. Inf. Model..
[13] Hyeong-Seok Lim,et al. Effects of ketoconazole and rifampicin on the pharmacokinetics of gemigliptin, a dipeptidyl peptidase-IV inhibitor: a crossover drug-drug interaction study in healthy male Korean volunteers. , 2012, Clinical therapeutics.
[14] Gretchen A. Stevens,et al. National, regional, and global trends in fasting plasma glucose and diabetes prevalence since 1980: systematic analysis of health examination surveys and epidemiological studies with 370 country-years and 2·7 million participants , 2011, The Lancet.
[15] Ye-Hwang Cheong,et al. Discovery of DA-1229: a potent, long acting dipeptidyl peptidase-4 inhibitor for the treatment of type 2 diabetes. , 2011, Bioorganic & medicinal chemistry letters.
[16] P. Lu,et al. Discovery of potent dipeptidyl peptidase IV inhibitors derived from β-aminoamides bearing substituted [1,2,3]-triazolopiperidines for the treatment of type 2 diabetes. , 2011, Bioorganic & medicinal chemistry letters.
[17] Dariusz Plewczynski,et al. VoteDock: Consensus docking method for prediction of protein–ligand interactions , 2011, J. Comput. Chem..
[18] J. Yano,et al. Discovery of a 3-pyridylacetic acid derivative (TAK-100) as a potent, selective and orally active dipeptidyl peptidase IV (DPP-4) inhibitor. , 2011, Journal of medicinal chemistry.
[19] E. Sugaru,et al. Discovery of new chemotype dipeptidyl peptidase IV inhibitors having (R)-3-amino-3-methyl piperidine as a pharmacophore. , 2010, Bioorganic & medicinal chemistry letters.
[20] J. Holst,et al. Linagliptin, a xanthine-based dipeptidyl peptidase-4 inhibitor with an unusual profile for the treatment of type 2 diabetes , 2010, Expert opinion on investigational drugs.
[21] Jianpeng Ma,et al. CHARMM: The biomolecular simulation program , 2009, J. Comput. Chem..
[22] C. Bailey,et al. Dipeptidyl peptidase IV (DPP IV) and related molecules in type 2 diabetes. , 2008, Frontiers in bioscience : a journal and virtual library.
[23] W. Metzler,et al. Involvement of DPP‐IV catalytic residues in enzyme–saxagliptin complex formation , 2008, Protein science : a publication of the Protein Society.
[24] G. Scapin,et al. Discovery of potent and selective dipeptidyl peptidase IV inhibitors derived from beta-aminoamides bearing subsituted triazolopiperazines. , 2008, Journal of medicinal chemistry.
[25] G. Scapin,et al. Design, synthesis, and biological evaluation of triazolopiperazine-based beta-amino amides as potent, orally active dipeptidyl peptidase IV (DPP-4) inhibitors. , 2007, Bioorganic & medicinal chemistry letters.
[26] D. Kassel,et al. Discovery of alogliptin: a potent, selective, bioavailable, and efficacious inhibitor of dipeptidyl peptidase IV. , 2007, Journal of medicinal chemistry.
[27] S. Dejager,et al. Addition of vildagliptin to insulin improves glycaemic control in type 2 diabetes , 2007, Diabetologia.
[28] R. Pratley,et al. Inhibition of DPP-4: a new therapeutic approach for the treatment of type 2 diabetes , 2007, Current medical research and opinion.
[29] Xin Wen,et al. BindingDB: a web-accessible database of experimentally determined protein–ligand binding affinities , 2006, Nucleic Acids Res..
[30] P. Bates,et al. Vildagliptin: a novel DPP-4 inhibitor with pancreatic islet enhancement activity for treatment of patients with type 2 diabetes. , 2006, Drugs of today.
[31] P. Flatt,et al. Function of a long‐term, GLP‐1‐treated, insulin‐secreting cell line is improved by preventing DPP IV‐mediated degradation of GLP‐1 , 2005, Diabetes, obesity & metabolism.
[32] R. Parker,et al. Discovery and preclinical profile of Saxagliptin (BMS-477118): a highly potent, long-acting, orally active dipeptidyl peptidase IV inhibitor for the treatment of type 2 diabetes. , 2005, Journal of medicinal chemistry.
[33] G. Scapin,et al. (2R)-4-oxo-4-[3-(trifluoromethyl)-5,6-dihydro[1,2,4]triazolo[4,3-a]pyrazin-7(8H)-yl]-1-(2,4,5-trifluorophenyl)butan-2-amine: a potent, orally active dipeptidyl peptidase IV inhibitor for the treatment of type 2 diabetes. , 2005, Journal of medicinal chemistry.
[34] A. Weber. Dipeptidyl peptidase IV inhibitors for the treatment of diabetes. , 2004, Journal of medicinal chemistry.
[35] Hege S. Beard,et al. Glide: a new approach for rapid, accurate docking and scoring. 2. Enrichment factors in database screening. , 2004, Journal of medicinal chemistry.
[36] Matthew P. Repasky,et al. Glide: a new approach for rapid, accurate docking and scoring. 1. Method and assessment of docking accuracy. , 2004, Journal of medicinal chemistry.
[37] T. Hughes,et al. 1-[2-[(5-Cyanopyridin-2-yl)amino]ethylamino]acetyl-2-(S)-pyrrolidinecarbonitrile: a potent, selective, and orally bioavailable dipeptidyl peptidase IV inhibitor with antihyperglycemic properties. , 2002, Journal of medicinal chemistry.
[38] Jong Young Joung,et al. Identification of Novel Rab27a/Melanophilin Blockers by Pharmacophore-Based Virtual Screening , 2013, Applied Biochemistry and Biotechnology.
[39] J. Yano,et al. Design and synthesis of 3-pyridylacetamide derivatives as dipeptidyl peptidase IV (DPP-4) inhibitors targeting a bidentate interaction with Arg125. , 2011, Bioorganic & medicinal chemistry.
[40] P. Willett,et al. PHARMACOPHORE PERCEPTION , DEVELOPMENT , AND USE IN DRUG DESIGN , 2011 .
[41] T. Kurtz,et al. Type 2 diabetes and oral antihyperglycemic drugs. , 2008, Current medicinal chemistry.
[42] G. Scapin,et al. (3R)-4-[(3R)-3-Amino-4-(2,4,5-trifluorophenyl)butanoyl]-3-(2,2,2-trifluoroethyl)-1,4-diazepan-2-one, a selective dipeptidyl peptidase IV inhibitor for the treatment of type 2 diabetes. , 2007, Bioorganic & medicinal chemistry letters.
[43] C. Venkatachalam,et al. LigandFit: a novel method for the shape-directed rapid docking of ligands to protein active sites. , 2003, Journal of molecular graphics & modelling.