Ying-Duo Gao

Ying-Duo Gao

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Ying-Duo Gao

Ying-Duo Gao

Publications by authors named "Ying-Duo Gao"

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25Publications

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Performance of multiple docking and refinement methods in the pose prediction D3R prospective Grand Challenge 2016.

J Comput Aided Mol Des 2018 01 14;32(1):113-127. Epub 2017 Sep 14.

Merck & Co., Inc., 2000 Galloping Hill Road, Kenilworth, NJ, 07033-1310, USA.

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http://dx.doi.org/10.1007/s10822-017-0053-2DOI Listing
January 2018

The discovery of novel 5,6,5- and 5,5,6-tricyclic pyrrolidines as potent and selective DPP-4 inhibitors.

Bioorg Med Chem Lett 2016 06 9;26(11):2622-6. Epub 2016 Apr 9.

Department of Chemistry, Merck Research Laboratories, 2015 Galloping Hill Road, Kenilworth, NJ 07033, USA.

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http://dx.doi.org/10.1016/j.bmcl.2016.04.020DOI Listing
June 2016

Discovery of Novel Tricyclic Heterocycles as Potent and Selective DPP-4 Inhibitors for the Treatment of Type 2 Diabetes.

ACS Med Chem Lett 2016 May 12;7(5):498-501. Epub 2016 Mar 12.

Department of Lead Optimization Chemistry, Department of Structural Chemistry, Department of Pharmacology, and Department of Pharmacokinetics, Pharmacodynamics, and Drug Metabolism, Merck Research Laboratories , 2015 Galloping Hill Road, Kenilworth, New Jersey 07033, United States.

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http://dx.doi.org/10.1021/acsmedchemlett.6b00027DOI Listing
http://www.ncbi.nlm.nih.gov/pmc/articles/PMC4867478PMC
May 2016

Structure-activity-relationship of amide and sulfonamide analogs of omarigliptin.

Bioorg Med Chem Lett 2015 Dec 30;25(24):5767-71. Epub 2015 Oct 30.

Department of Discovery Chemistry, Merck Research Laboratories, 2015 Galloping Hill Road, Kenilworth, NJ 07033, United States.

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http://dx.doi.org/10.1016/j.bmcl.2015.10.070DOI Listing
December 2015

Omarigliptin (MK-3102): a novel long-acting DPP-4 inhibitor for once-weekly treatment of type 2 diabetes.

J Med Chem 2014 Apr 2;57(8):3205-12. Epub 2014 Apr 2.

Department of Discovery Chemistry, ‡Department of Metabolic Disorders, §Department of Pharmacology, ∥Department of Drug Metabolism, ⊥Basic Pharmaceutical Sciences, and #Department of Safety Assessment and Animal Resources, Merck & Co., Inc. , Whitehouse Station, New Jersey 08889, United States.

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http://dx.doi.org/10.1021/jm401992eDOI Listing
April 2014

Drug-like density: a method of quantifying the "bindability" of a protein target based on a very large set of pockets and drug-like ligands from the Protein Data Bank.

J Chem Inf Model 2010 Nov 26;50(11):2029-40. Epub 2010 Oct 26.

Chemistry Modeling and Informatics Department, Merck Research Laboratories, Rahway, New Jersey 07065, USA.

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http://pubs.acs.org/doi/abs/10.1021/ci100312t
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http://dx.doi.org/10.1021/ci100312tDOI Listing
November 2010

Discovery of new binding elements in DPP-4 inhibition and their applications in novel DPP-4 inhibitor design.

Bioorg Med Chem Lett 2008 Jul 20;18(13):3706-10. Epub 2008 May 20.

Research Laboratories, Department of Medicinal Chemistry, Merck & Co., Inc., PO Box 2000, Rahway, NJ 07065, USA.

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http://dx.doi.org/10.1016/j.bmcl.2008.05.061DOI Listing
July 2008

Functional mapping of the transient receptor potential vanilloid 1 intracellular binding site.

Mol Pharmacol 2006 Sep 8;70(3):1005-12. Epub 2006 Jun 8.

The Neuroscience Research Centre, Merck Sharp & Dohme, Terlings Park, Harlow, Essex, United Kingdom.

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http://dx.doi.org/10.1124/mol.106.023945DOI Listing
September 2006

Resiniferatoxin binds to the capsaicin receptor (TRPV1) near the extracellular side of the S4 transmembrane domain.

Biochemistry 2004 Mar;43(9):2501-11

Department of Ion Channels, Merck Research Laboratories, Rahway, New Jersey 07065, USA.

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http://pubs.acs.org/doi/abs/10.1021/bi035981h
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http://dx.doi.org/10.1021/bi035981hDOI Listing
March 2004

Interaction of agitoxin2, charybdotoxin, and iberiotoxin with potassium channels: selectivity between voltage-gated and Maxi-K channels.

Proteins 2003 Aug;52(2):146-54

Molecular Systems, Merck Research Laboratories, Rahway, New Jersey 07065, USA.

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http://doi.wiley.com/10.1002/prot.10341
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http://dx.doi.org/10.1002/prot.10341DOI Listing
August 2003

Glycine 30 in iberiotoxin is a critical determinant of its specificity for maxi-K versus K(V) channels.

FEBS Lett 2002 Sep;527(1-3):298-302

Department of Biochemistry, Temple University School of Medicine, 3420 N. Broad Street, Philadelphia, PA 19140, USA.

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http://dx.doi.org/10.1016/s0014-5793(02)03256-8DOI Listing
September 2002