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1

A novel dopamine D3R agonist SK609 with norepinephrine transporter inhibition promotes improvement in cognitive task performance in rodent and non-human primate models of Parkinson's disease

Schneider, Jay S., Marshall, Courtney A., Keibel, Lauren, Snyder, Nathaniel W., Hill, Michael P., Brotchie, Jonathan M., Johnston, Tom H., Waterhouse, Barry D., Kortagere, Sandhya

Journal:

Experimental Neurology

Year:

2021

File:

PDF, 61 KB

2021

2

Troubleshooting computational methods in drug discovery

Sandhya Kortagere, Sean Ekins

Journal:

Journal of Pharmacological and Toxicological Methods

Year:

2010

Language:

english

File:

PDF, 752 KB

english, 2010

3

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || In Silico Systems Biology Approaches for the Identification of Antimicrobial Targets

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 486 KB

english, 2013

4

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 ||

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 7.57 MB

english, 2013

5

Functional characterization of a Novel Series of Biased Signaling Dopamine D3 Receptor Agonists

Xu, Wei, Wang, Xiaozhao, Tocker, Aaron M., Huang, Peng, Reith, Maarten E.A., Liu-Chen, Lee-Yuan, Smith, III, Amos B, Kortagere, Sandhya

Journal:

ACS Chemical Neuroscience

Year:

2016

Language:

english

File:

PDF, 2.36 MB

english, 2016

6

Identification of novel allosteric modulators of glutamate transporter EAAT2

Kortagere, Sandhya, Mortensen, Ole Valente, Xia, Jingsheng, Lester, William, Fang, Yuhong, Srikanth, Yellamelli V. V., Salvino, Joseph M., Fontana, Andreia Cristina Karklin

Journal:

ACS Chemical Neuroscience

Year:

2017

Language:

english

File:

PDF, 2.20 MB

english, 2017

7

Biased signaling agonist of Dopamine D3 receptor induces receptor internalization independent of β-Arrestin recruitment

Xu, Wei, Reith, Maarten E.A., Chen, Lee-Yuan Liu, Kortagere, Sandhya

Journal:

Pharmacological Research

Year:

2019

Language:

english

File:

PDF, 1.82 MB

english, 2019

8

Reciprocal Mutations in TM2/TM3 in a D2 Dopamine Receptor Background Confirms the Importance of this Microdomain as a Selective Determinant of Para-Halogenated 1,4-Disubstituted Aromatic Piperazines

Christina Z. Floresca, Shiuhwei Chen, Sandhya Kortagere, John A. Schetz

Journal:

Archiv der Pharmazie

Year:

2005

Language:

english

File:

PDF, 204 KB

english, 2005

9

Novel delta opioid receptor agonists exhibit differential stimulation of signaling pathways

Youyi Peng, Qiang Zhang, Sonia Arora, Susan M. Keenan, Sandhya Kortagere, Kenneth M. Wannemacher, Richard D. Howells, William J. Welsh

Journal:

Bioorganic & Medicinal Chemistry

Year:

2009

Language:

english

File:

PDF, 617 KB

english, 2009

10

Halogenated ligands and their interactions with amino acids: Implications for structure–activity and structure–toxicity relationships

Sandhya Kortagere, Sean Ekins, William J. Welsh

Journal:

Journal of Molecular Graphics and Modelling

Year:

2008

Language:

english

File:

PDF, 869 KB

english, 2008

11

Histone deacetylase activity is necessary for left-right patterning during vertebrate development

Katia Carneiro, Claudia Donnet, Tomas Rejtar, Barry L Karger, Gustavo A Barisone, Elva Díaz, Sandhya Kortagere, Joan M Lemire, Michael Levin

Journal:

BMC Developmental Biology

Year:

2011

Language:

english

File:

PDF, 2.40 MB

english, 2011

12

Ab initio computational modeling of loops in G-protein-coupled receptors: Lessons from the crystal structure of rhodopsin

Ernest L. Mehler, Sergio A. Hassan, Sandhya Kortagere, Harel Weinstein

Journal:

Proteins: Structure, Function, and Bioinformatics

Year:

2006

Language:

english

File:

PDF, 991 KB

english, 2006

13

Development and application of hybrid structure based method for efficient screening of ligands binding to G-protein coupled receptors

Sandhya Kortagere, William J. Welsh

Journal:

Journal of Computer-Aided Molecular Design

Year:

2006

Language:

english

File:

PDF, 606 KB

english, 2006

14

Ab initio computational modeling of long loops in G-protein coupled receptors

Sandhya Kortagere, Amitava Roy, Ernest L. Mehler

Journal:

Journal of Computer-Aided Molecular Design

Year:

2006

Language:

english

File:

PDF, 344 KB

english, 2006

15

Rapid discovery of inhibitors ofToxoplasma gondiiusing hybrid structure-based computational approach

Sandhya Kortagere, Ernest Mui, Rima McLeod, William J. Welsh

Journal:

Journal of Computer-Aided Molecular Design

Year:

2011

Language:

english

File:

PDF, 908 KB

english, 2011

16

New Predictive Models for Blood–Brain Barrier Permeability of Drug-like Molecules

Sandhya Kortagere, Dmitriy Chekmarev, William J. Welsh, Sean Ekins

Journal:

Pharmaceutical Research

Year:

2008

Language:

english

File:

PDF, 335 KB

english, 2008

17

Hybrid Scoring and Classification Approaches to Predict Human Pregnane X Receptor Activators

Sandhya Kortagere, Dmitriy Chekmarev, William J. Welsh, Sean Ekins

Journal:

Pharmaceutical Research

Year:

2009

Language:

english

File:

PDF, 377 KB

english, 2009

18

Predicting Inhibitors of Acetylcholinesterase by Regression and Classification Machine Learning Approaches with Combinations of Molecular Descriptors

Dmitriy Chekmarev, Vladyslav Kholodovych, Sandhya Kortagere, William J. Welsh, Sean Ekins

Journal:

Pharmaceutical Research

Year:

2009

Language:

english

File:

PDF, 228 KB

english, 2009

19

Identification and Characterization of a Novel Class of Atypical Dopamine Receptor Agonists

E. V. Kuzhikandathil, S. Kortagere

Journal:

Pharmaceutical Research

Year:

2012

Language:

english

File:

PDF, 651 KB

english, 2012

20

Development of tolerance in D3 dopamine receptor signaling is accompanied by distinct changes in receptor conformation

Ligia Westrich, Sara Gil-Mast, Sandhya Kortagere, Eldo V. Kuzhikandathil

Journal:

Biochemical Pharmacology

Year:

2010

Language:

english

File:

PDF, 1.62 MB

english, 2010

21

Interaction of novel hybrid compounds with the D3 dopamine receptor: Site-directed mutagenesis and homology modeling studies

Sandhya Kortagere, Shu-Yuan Cheng, Tamara Antonio, Juan Zhen, Maarten E.A. Reith, Aloke K. Dutta

Journal:

Biochemical Pharmacology

Year:

2011

Language:

english

File:

PDF, 611 KB

english, 2011

22

Structure-based Design of Novel Small-Molecule Inhibitors of Plasmodium falciparum

Kortagere, Sandhya, Welsh, William J., Morrisey, Joanne M., Daly, Thomas, Ejigiri, Ijeoma, Sinnis, Photini, Vaidya, Akhil B., Bergman, Lawrence W.

Journal:

Journal of Chemical Information and Modeling

Year:

2010

Language:

english

File:

PDF, 3.54 MB

english, 2010

23

The importance of discerning shape in molecular pharmacology

Sandhya Kortagere, Matthew D. Krasowski, Sean Ekins

Journal:

Trends in Pharmacological Sciences

Year:

2009

Language:

english

File:

PDF, 877 KB

english, 2009

24

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Rational Design of HIV-1 Entry Inhibitors

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 453 KB

english, 2013

25

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || In Silico Models for B-Cell Epitope Recognition and Signaling

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 225 KB

english, 2013

26

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Genome Comparisons as a Tool for Antimicrobial Target Discovery

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 313 KB

english, 2013

27

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || In Silico Models for Drug Resistance

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 494 KB

english, 2013

28

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Virtual Screening in Drug Design

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 331 KB

english, 2013

29

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Molecular Dynamics Simulations in Drug Design

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 394 KB

english, 2013

30

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || On Exploring Structure–Activity Relationships

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 489 KB

english, 2013

31

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Designing Novel Inhibitors of Trypanosoma brucei

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 432 KB

english, 2013

32

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || The Collaborative Drug Discovery (CDD) Database

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 558 KB

english, 2013

33

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || An In Silico Model for Interpreting Polypharmacology in Drug–Target Networks

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 398 KB

english, 2013

34

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Identification of Novel Anthrax Toxin Countermeasures Using In Silico Methods

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 293 KB

english, 2013

35

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Malarial Kinases: Novel Targets for In Silico Approaches to Drug Discovery

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 308 KB

english, 2013

36

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Databases and In Silico Tools for Vaccine Design

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 265 KB

english, 2013

37

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Computational Models for Tuberculosis Drug Discovery

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 371 KB

english, 2013

38

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || Recognition of Nontrivial Remote Homology Relationships Involving Proteins of Helicobacter pylori: Implications for Function Recognition

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 3.59 MB

english, 2013

39

[Methods in Molecular Biology] In Silico Models for Drug Discovery Volume 993 || || Front_matter

Kortagere, Sandhya

Year:

2013

Language:

english

File:

PDF, 325 KB

english, 2013

40

Identification of an allosteric modulator of the serotonin transporter with novel mechanism of action

Kortagere, Sandhya, Fontana, Andreia Cristina Karklin, Rose, Deja Renée, Mortensen, Ole Valente

Journal:

Neuropharmacology

Year:

2013

Language:

english

File:

PDF, 1.29 MB

english, 2013

41

Plasmodium Dipeptidyl Aminopeptidases as Malaria Transmission-Blocking Drug Targets

Tanaka, T. Q., Deu, E., Molina-Cruz, A., Ashburne, M. J., Ali, O., Suri, A., Kortagere, S., Bogyo, M., Williamson, K. C.

Journal:

Antimicrobial Agents and Chemotherapy

Year:

2013

Language:

english

File:

PDF, 1.51 MB

english, 2013

42

Plant flavonol isorhamnetin attenuates chemically induced inflammatory bowel disease via a PXR-dependent pathway

Dou, Wei, Zhang, Jingjing, Li, Hao, Kortagere, Sandhya, Sun, Katherine, Ding, Lili, Ren, Gaiyan, Wang, Zhengtao, Mani, Sridhar

Journal:

The Journal of Nutritional Biochemistry

Year:

2014

Language:

english

File:

PDF, 1.24 MB

english, 2014

43

Hybrid Scoring and Classification Using Shape-Based Approaches to Predict Human PXR Activators

Kortagere, Sandhya, Chekmarev, Dmitriy, Welsh, William J., Ekins, Sean

Journal:

Biophysical Journal

Year:

2009

Language:

english

File:

PDF, 44 KB

english, 2009

44

Sa1774 Regulation of Intestinal Mucosal Barrier Function by Specific Microbial Metabolites

Mukherjee, Subhajit, Venkatesh, Madhukumar, Wang, Hongwei, Phillips, Robert S., Kortagere, Sandhya, Khanna, Kamal M., Mani, Sridhar

Journal:

Gastroenterology

Year:

2014

Language:

english

File:

PDF, 51 KB

english, 2014

45

Small Molecule HIV-1 Capsid Inhibitor Design using Hybrid Structure Based Methods

Kortagere, Sandhya, Madani, Navid, Mankowski, Marie K., Princiotto, Amy, Anthony, Kevin, Sierra, Luz-Jeannette, Wang, Xiaozhao, Jones, David M., Courter, Joel R., Stavale, Eric, Ptak, Roger, Smith, Am

Journal:

Biophysical Journal

Year:

2011

Language:

english

File:

PDF, 35 KB

english, 2011

46

Quaternary Benzyltriethylammonium Ion Binding to the Na,K-ATPase: A Tool to Investigate Extracellular K + Binding Reactions

Peluffo, R. Daniel, González-Lebrero, Rodolfo M., Kaufman, Sergio B., Kortagere, Sandhya, Orban, Branly, Rossi, Rolando C., Berlin, Joshua R.

Journal:

Year:

2009

Language:

english

File:

PDF, 1.76 MB

english, 2009

47

Children's Health 2010 || Evaluation of Computational Docking to Identify Pregnane X Receptor Agonists in the ToxCast Database

Sandhya Kortagere, Matthew D. Krasowski, Erica J. Reschly, Madhukumar Venkatesh, Sridhar Mani and Sean Ekins

Journal:

Environmental Health Perspectives

Year:

2010

Language:

english

File:

PDF, 1.52 MB

english, 2010

48

An Amino Acid Residue in the Second Extracellular Loop Determines the Agonist-Dependent Tolerance Property of the Human D3 Dopamine Receptor

Gil-Mast, Sara, Kortagere, Sandhya, Kota, Kokila, Kuzhikandathil, Eldo V.

Journal:

ACS Chemical Neuroscience

Year:

2013

Language:

english

File:

PDF, 4.02 MB

english, 2013

49

Structure–Activity Relationships of a Novel Capsid Targeted Inhibitor of HIV-1 Replication

Kortagere, Sandhya, Xu, Jimmy P., Mankowski, Marie K., Ptak, Roger G., Cocklin, Simon

Journal:

Journal of Chemical Information and Modeling

Year:

2014

Language:

english

File:

PDF, 1.76 MB

english, 2014

50

Structure−Activity Relations of Nanolipoblockers with the Atherogenic Domain of Human Macrophage Scavenger Receptor A

Plourde, Nicole M., Kortagere, Sandhya, Welsh, William, Moghe, Prabhas V.

Journal:

Biomacromolecules

Year:

2009

Language:

english

File:

PDF, 3.99 MB

english, 2009