Publications:

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A structure-based computational workflow to predict liability and binding modes of small molecules to hERG.

Scientific Reports

Kalyaanamoorthy, Subha S; Lamothe, Shawn M SM; Hou, Xiaoqing X; Moon, Tae Chul TC; Kurata, Harley T HT; Houghton, Michael M; Barakat, Khaled H KH

Publication Date: 2020-10-01

Variant appearance in text: HERG: T623A

PubMed Link: 33004839

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• 41598_2020_Article_72889.pdf

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Enhancing rare variant interpretation in inherited arrhythmias through quantitative analysis of consortium disease cohorts and population controls.

Genetics In Medicine : Official Journal Of The American College Of Medical Genetics

Walsh, Roddy R; Lahrouchi, Najim N; Tadros, Rafik R; Kyndt, Florence F; Glinge, Charlotte C; Postema, Pieter G PG; Amin, Ahmad S AS; Nannenberg, Eline A EA; Ware, James S JS; Whiffin, Nicola N; Mazzarotto, Francesco F; Škorić-Milosavljević, Doris D; Krijger, Christian C; Arbelo, Elena E; Babuty, Dominique D; Barajas-Martinez, Hector H; Beckmann, Britt M BM; Bézieau, Stéphane S; Bos, J Martijn JM; Breckpot, Jeroen J; Campuzano, Oscar O; Castelletti, Silvia S; Celen, Candan C; Clauss, Sebastian S; Corveleyn, Anniek A; Crotti, Lia L; Dagradi, Federica F; de Asmundis, Carlo C; Denjoy, Isabelle I; Dittmann, Sven S; Ellinor, Patrick T PT; Ortuño, Cristina Gil CG; Giustetto, Carla C; Gourraud, Jean-Baptiste JB; Hazeki, Daisuke D; Horie, Minoru M; Ishikawa, Taisuke T; Itoh, Hideki H; Kaneko, Yoshiaki Y; Kanters, Jørgen K JK; Kimoto, Hiroki H; Kotta, Maria-Christina MC; Krapels, Ingrid P C IPC; Kurabayashi, Masahiko M; Lazarte, Julieta J; Leenhardt, Antoine A; Loeys, Bart L BL; Lundin, Catarina C; Makiyama, Takeru T; Mansourati, Jacques J; Martins, Raphaël P RP; Mazzanti, Andrea A; Mörner, Stellan S; Napolitano, Carlo C; Ohkubo, Kimie K; Papadakis, Michael M; Rudic, Boris B; Molina, Maria Sabater MS; Sacher, Frédéric F; Sahin, Hatice H; Sarquella-Brugada, Georgia G; Sebastiano, Regina R; Sharma, Sanjay S; Sheppard, Mary N MN; Shimamoto, Keiko K; Shoemaker, M Benjamin MB; Stallmeyer, Birgit B; Steinfurt, Johannes J; Tanaka, Yuji Y; Tester, David J DJ; Usuda, Keisuke K; van der Zwaag, Paul A PA; Van Dooren, Sonia S; Van Laer, Lut L; Winbo, Annika A; Winkel, Bo G BG; Yamagata, Kenichiro K; Zumhagen, Sven S; Volders, Paul G A PGA; Lubitz, Steven A SA; Antzelevitch, Charles C; Platonov, Pyotr G PG; Odening, Katja E KE; Roden, Dan M DM; Roberts, Jason D JD; Skinner, Jonathan R JR; Tfelt-Hansen, Jacob J; van den Berg, Maarten P MP; Olesen, Morten S MS; Lambiase, Pier D PD; Borggrefe, Martin M; Hayashi, Kenshi K; Rydberg, Annika A; Nakajima, Tadashi T; Yoshinaga, Masao M; Saenen, Johan B JB; Kääb, Stefan S; Brugada, Pedro P; Robyns, Tomas T; Giachino, Daniela F DF; Ackerman, Michael J MJ; Brugada, Ramon R; Brugada, Josep J; Gimeno, Juan R JR; Hasdemir, Can C; Guicheney, Pascale P; Priori, Silvia G SG; Schulze-Bahr, Eric E; Makita, Naomasa N; Schwartz, Peter J PJ; Shimizu, Wataru W; Aiba, Takeshi T; Schott, Jean-Jacques JJ; Redon, Richard R; Ohno, Seiko S; Probst, Vincent V; , ; Behr, Elijah R ER; Barc, Julien J; Bezzina, Connie R CR

Publication Date: 2021-01

Variant appearance in text: KCNH2: 1867A>G; Thr623Ala

PubMed Link: 32893267

Variant Present in the following documents:

• 41436_2020_946_MOESM2_ESM.xlsx, sheet 4

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An Update on the Structure of hERG.

Frontiers In Pharmacology

Butler, Andrew A; Helliwell, Matthew V MV; Zhang, Yihong Y; Hancox, Jules C JC; Dempsey, Christopher E CE

Publication Date: 2019

Variant appearance in text: KCNH2: T623A

PubMed Link: 32038248

Variant Present in the following documents:

• Main text
• fphar-10-01572.pdf

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Cardiac toxicity of Triptergium wilfordii Hook F. may correlate with its inhibition to hERG channel.

Heliyon

Zhao, Wei W; Xiao, Liping L; Pan, Lanying L; Ke, Xianfu X; Zhang, Yanting Y; Zhong, Dian D; Xu, Jianwei J; Cao, Fumin F; Wu, Liren L; Chen, Yuan Y

Publication Date: 2019-10

Variant appearance in text: HERG: T623A

PubMed Link: 31667381

Variant Present in the following documents:

• main.pdf

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The molecular determinants of R-roscovitine block of hERG channels.

Plos One

Cernuda, Bryan B; Fernandes, Christopher Thomas CT; Allam, Salma Mohamed SM; Orzillo, Matthew M; Suppa, Gabrielle G; Chia Chang, Zuleen Z; Athanasopoulos, Demosthenes D; Buraei, Zafir Z

Publication Date: 2019

Variant appearance in text: Kv11.1: T623A

PubMed Link: 31479461

Variant Present in the following documents:

• Main text
• pone.0217733.pdf

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Electrophysiological mechanisms of vandetanib-induced cardiotoxicity: Comparison of action potentials in rabbit Purkinje fibers and pluripotent stem cell-derived cardiomyocytes.

Plos One

Lee, Hyang-Ae HA; Hyun, Sung-Ae SA; Byun, Byungjin B; Chae, Jong-Hak JH; Kim, Ki-Suk KS

Publication Date: 2018

Variant appearance in text: HERG: T623A

PubMed Link: 29630634

Variant Present in the following documents:

• pone.0195577.pdf

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Structural implications of hERG K+ channel block by a high-affinity minimally structured blocker.

The Journal Of Biological Chemistry

Helliwell, Matthew V MV; Zhang, Yihong Y; El Harchi, Aziza A; Du, Chunyun C; Hancox, Jules C JC; Dempsey, Christopher E CE

Publication Date: 2018-05-04

Variant appearance in text: HERG: T623A

PubMed Link: 29545312

Variant Present in the following documents:

• zbc7040.pdf

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Interactions between amiodarone and the hERG potassium channel pore determined with mutagenesis and in silico docking.

Biochemical Pharmacology

Zhang, Yihong Y; Colenso, Charlotte K CK; El Harchi, Aziza A; Cheng, Hongwei H; Witchel, Harry J HJ; Dempsey, Chris E CE; Hancox, Jules C JC

Publication Date: 2016-08-01

Variant appearance in text: HERG: T623A

PubMed Link: 27256139

Variant Present in the following documents:

• Main text
• main.pdf

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Molecular basis of hERG potassium channel blockade by the class Ic antiarrhythmic flecainide.

Journal Of Molecular And Cellular Cardiology

Melgari, Dario D; Zhang, Yihong Y; El Harchi, Aziza A; Dempsey, Christopher E CE; Hancox, Jules C JC

Publication Date: 2015-09

Variant appearance in text: HERG: T623A

PubMed Link: 26159617

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• Main text
• main.pdf

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The Link between Inactivation and High-Affinity Block of hERG1 Channels.

Molecular Pharmacology

Wu, Wei W; Gardner, Alison A; Sanguinetti, Michael C MC

Publication Date: 2015-06

Variant appearance in text: KCNH2: T623A

PubMed Link: 25855787

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• Main text

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Ranolazine inhibition of hERG potassium channels: drug-pore interactions and reduced potency against inactivation mutants.

Journal Of Molecular And Cellular Cardiology

Du, Chunyun C; Zhang, Yihong Y; El Harchi, Aziza A; Dempsey, Christopher E CE; Hancox, Jules C JC

Publication Date: 2014-09

Variant appearance in text: HERG: T623A

PubMed Link: 24877995

Variant Present in the following documents:

• mmc1.pdf

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Assessing hERG pore models as templates for drug docking using published experimental constraints: the inactivated state in the context of drug block.

Journal Of Chemical Information And Modeling

Dempsey, Christopher E CE; Wright, Dominic D; Colenso, Charlotte K CK; Sessions, Richard B RB; Hancox, Jules C JC

Publication Date: 2014-02-24

Variant appearance in text: HERG: T623A

PubMed Link: 24471705

Variant Present in the following documents:

• Main text
• ci400707h.pdf

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Molecular coupling in the human ether-a-go-go-related gene-1 (hERG1) K+ channel inactivation pathway.

The Journal Of Biological Chemistry

Ferrer, Tania T; Cordero-Morales, Julio F JF; Arias, Marcelo M; Ficker, Eckhard E; Medovoy, David D; Perozo, Eduardo E; Tristani-Firouzi, Martin M

Publication Date: 2011-11-11

Variant appearance in text: KCNH2: T623A

PubMed Link: 21908602

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• Main text

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Stereoselective Inhibition of the hERG1 Potassium Channel.

Frontiers In Pharmacology

Grilo, Liliana Sintra LS; Carrupt, Pierre-Alain PA; Abriel, Hugues H

Publication Date: 2010

Variant appearance in text: KCNH2: T623A

PubMed Link: 21833176

Variant Present in the following documents:

• Main text
• fphar-01-00137.pdf

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Molecular determinants for activation of human ether-à-go-go-related gene 1 potassium channels by 3-nitro-n-(4-phenoxyphenyl) benzamide.

Molecular Pharmacology

Garg, Vivek V; Stary-Weinzinger, Anna A; Sachse, Frank F; Sanguinetti, Michael C MC

Publication Date: 2011-10

Variant appearance in text: KCNH2: T623A

PubMed Link: 21743002

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• Main text

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Role of voltage-gated sodium, potassium and calcium channels in the development of cocaine-associated cardiac arrhythmias.

British Journal Of Clinical Pharmacology

O'Leary, Michael E ME; Hancox, Jules C JC

Publication Date: 2010-05

Variant appearance in text: KCNH2: T623A

PubMed Link: 20573078

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• Main text

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Molecular determinants of hERG channel block by terfenadine and cisapride.

Journal Of Pharmacological Sciences

Kamiya, Kaichiro K; Niwa, Ryoko R; Morishima, Mikio M; Honjo, Haruo H; Sanguinetti, Michael C MC

Publication Date: 2008-11

Variant appearance in text: HERG: T623A

PubMed Link: 18987434

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The 5-HT2 antagonist ketanserin is an open channel blocker of human cardiac ether-à-go-go-related gene (hERG) potassium channels.

British Journal Of Pharmacology

Tang, Q Q; Li, Z-Q ZQ; Li, W W; Guo, J J; Sun, H-Y HY; Zhang, X-H XH; Lau, C-P CP; Tse, H-F HF; Zhang, S S; Li, G-R GR

Publication Date: 2008-10

Variant appearance in text: HERG: T623A

PubMed Link: 18574455

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Probing the binding sites and mechanisms of action of two human ether-a-go-go-related gene channel activators, 1,3-bis-(2-hydroxy-5-trifluoromethyl-phenyl)-urea (NS1643) and 2-[2-(3,4-dichloro-phenyl)-2,3-dihydro-1H-isoindol-5-ylamino]-nicotinic acid (PD307243).

Molecular Pharmacology

Xu, Xulin X; Recanatini, Maurizio M; Roberti, Marinella M; Tseng, Gea-Ny GN

Publication Date: 2008-06

Variant appearance in text: LQT2: T623A

PubMed Link: 18372399

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• Main text

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Na+ permeation and block of hERG potassium channels.

The Journal Of General Physiology

Gang, Hongying H; Zhang, Shetuan S

Publication Date: 2006-07

Variant appearance in text: HERG: T623A

PubMed Link: 16769794

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• Main text
• jgp1280055.pdf

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Position of aromatic residues in the S6 domain, not inactivation, dictates cisapride sensitivity of HERG and eag potassium channels.

Proceedings Of The National Academy Of Sciences Of The United States Of America

Chen, Jun J; Seebohm, Guiscard G; Sanguinetti, Michael C MC

Publication Date: 2002-09-17

Variant appearance in text: HERG: T623A

PubMed Link: 12209010

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A structural basis for drug-induced long QT syndrome.

Proceedings Of The National Academy Of Sciences Of The United States Of America

Mitcheson, J S JS; Chen, J J; Lin, M M; Culberson, C C; Sanguinetti, M C MC

Publication Date: 2000-10-24

Variant appearance in text: HERG: T623A

PubMed Link: 11005845

Variant Present in the following documents:

• Main text

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