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Drug Design, Development and Therapy Volume 8, 2014 - Issue
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Original Research

Combining structure-based pharmacophore modeling, virtual screening, and in silico ADMET analysis to discover novel tetrahydro-quinoline based pyruvate kinase isozyme M2 activators with antitumor activity

Can Chen1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China;2 College of Pharmacy and the First Affiliated Hospital, Chengdu Medical College, Chengdu, People’s Republic of China
,
Ting Wang1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China;3 Department of Cardiology, General Hospital of Chengdu Military Command, Chengdu, People’s Republic of China
,
Fengbo Wu1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China
,
Wei Huang4 State Key Laboratory Breeding Base of Systematic Research, Development and Utilization of Chinese Medicine, Chengdu University of Traditional Chinese Medicine, Chengdu, People’s Republic of China
,
Gu He1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of ChinaCorrespondence[email protected] [email protected]
,
Liang Ouyang1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China
,
Mingli Xiang1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China
,
Cheng Peng4 State Key Laboratory Breeding Base of Systematic Research, Development and Utilization of Chinese Medicine, Chengdu University of Traditional Chinese Medicine, Chengdu, People’s Republic of China
&
Qinglin Jiang1 State Key Laboratory of Biotherapy and Department of Pharmacy, West China Hospital, Sichuan University, Chengdu, People’s Republic of China;2 College of Pharmacy and the First Affiliated Hospital, Chengdu Medical College, Chengdu, People’s Republic of ChinaCorrespondence[email protected] [email protected]
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Pages 1195-1210 | Published online: 02 Sep 2014

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