Rational design of novel N‐alkyl amine analogues of noscapine, their chemical synthesis and cellular activity as potent anticancer agents

@article{Meher2021RationalDO,
  title={Rational design of novel N‐alkyl amine analogues of noscapine, their chemical synthesis and cellular activity as potent anticancer agents},
  author={Rajesh Kumar Meher and Pratyush Pragyandipta and Ravi Kumar Pedapati and Praveen K R Nagireddy and Srinivas Kantevari and Arnab Nayek and Pradeep K Naik},
  journal={Chemical Biology \& Drug Design},
  year={2021},
  volume={98},
  pages={445 - 465}
}
The scaffold structure of noscapine (an antitussive plant alkaloid) was modified by inducting N‐aryl methyl pharmacophore at C‐9 position of the isoquinoline ring to rationally design and screened three novel 9‐(N‐arylmethylamino) noscapinoids, 15–17 with robust binding affinity with tubulin. The selected 9‐(N‐arylmethylamino) noscapinoids revealed improved predicted binding energy of −6.694 kcal/mol for 15, −7.118 kcal/mol for 16 and −7.732 kcal/mol for 17, respectively in comparison to the… 
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