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Pharmacophore elucidation for a new series of 2-aryl-pyrazolo-triazolo-pyrimidines as potent human A3 adenosine receptor antagonists
Authors:Cheong Siew Lee  Federico Stephanie  Venkatesan Gopalakrishnan  Paira Priyankar  Shao Yi-Ming  Spalluto Giampiero  Yap Chun Wei  Pastorin Giorgia
Institution:a Department of Pharmacy, National University of Singapore, 3 Science Drive 2, Block S15, #05-PI-03, Singapore 117543, Singapore
b Dipartimento di Scienze Farmaceutiche, Università degli Studi di Trieste, Piazzale Europa 1, I-34127 Trieste, Italy
c Department of Pharmacy, National University of Singapore, 18 Science Drive 4, Block S7, #02-06, Singapore 117543, Singapore
Abstract:
Keywords:CoMFA  comparative molecular field analysis  cAMP  cyclic adenosine monophosphate  ECL2  extracellular loop 2  GPCR  G protein-coupled receptor  hA3AR  human A3 adenosine receptor  MAPK  mitogen-activated protein kinase  MOE  molecular operating environment  PLS  partial-least-square  PQ  pyrazoloquinolines  PTP  pyrazolo-triazolo-pyrimidines  TBT  triazolobenzotriazinones  TM  transmembrane  TP  triazolopyrazinones  TQX  triazoloquinoxalinones
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