I, II, III, were synthesized by the condensation of 3,5-dichloro-salicylaldehyde, 3-bromo-5-chloro-salicylaldehyde, and 3,5-dibromo-salicylaldehyde with isatin monohydrazone, respectively. Three new unsymmetric isatin bishydrazone compounds Comp.

These examples show that it is possible to improve and kickstart research from scarce available data to design and discover new potential drugs. Issues in the face of data scarcity, including complex problems such as the challenging scenario of drug design aimed at intrinsically disordered proteins and the evaluation of potential adverse effects in a clinical scenario. Here, approaches that may help provide solutions to generate or obtain enough relevant data or improve/accelerate existing methods within the last five years were reviewed.Īreas covered: One-shot learning (OSL) approaches, structural modeling, molecular docking, scoring function space (SFS), molecular dynamics (MD), and quantum mechanics (QM) may be used to amplify the amount of available data to drug design and discovery campaigns, presenting methods, their perspectives, and discussions to be employed in the near future.Įxpert opinion: Recent works have successfully used these techniques to solve a range of

The lack of biological and/or chemical data tends to slow the development of scientific research and innovation. Introduction: Modern drug discovery generally is accessed by useful information from previous large databases or uncovering novel data.

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