New hypotheses for the binding mode of 4-and 7-substituted indazoles in the active site of neuronal nitric oxide synthase

E Lohou, J Sopkova-de Oliveira Santos…

Index: Lohou, Elodie; Sopkova-De Oliveira Santos, Jana; Schumann-Bard, Pascale; Boulouard, Michel; Stiebing, Silvia; Rault, Sylvain; Collot, Valerie Bioorganic and Medicinal Chemistry, 2012 , vol. 20, # 17 p. 5296 - 5304

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Citation Number: 6

Abstract

Taking into account the potency of 4-and 7-nitro and haloindazoles as nNOS inhibitors previously reported in the literature by our team, a multidisciplinary study, described in this article, has recently been carried out to elucidate their binding mode in the enzyme active site. Firstly, nitrogenous fastening points on the indazole building block have been investigated referring to molecular modeling hypotheses and thanks to the in vitro ...

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New hypotheses for the binding mode of 4-and 7-substituted indazoles in the active site of neuronal nitric oxide synthase

[Bioorganic and Medicinal Chemistry, , vol. 20, # 17 p. 5296 - 5304]