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Crystal structures of non-uracil ring fragments in complex with Mycobacterium tuberculosis uracil DNA glycosylase (MtUng) as a starting point for novel inhibitor design: A case study with the barbituric acid fragment.
Kesharwani S, Raj P, Paul A, Roy K, Bhanot A, Mehta A, Gopal A, Varshney U, Gopal B, Sundriyal S. Kesharwani S, et al. Among authors: varshney u. Eur J Med Chem. 2023 Oct 5;258:115604. doi: 10.1016/j.ejmech.2023.115604. Epub 2023 Jun 28. Eur J Med Chem. 2023. PMID: 37399710
Identification of a new and diverse set of Mycobacterium tuberculosis uracil-DNA glycosylase (MtUng) inhibitors using structure-based virtual screening: Experimental validation and molecular dynamics studies.
Raj P, Selvam K, Roy K, Mani Tripathi S, Kesharwani S, Gopal B, Varshney U, Sundriyal S. Raj P, et al. Among authors: varshney u. Bioorg Med Chem Lett. 2022 Nov 15;76:129008. doi: 10.1016/j.bmcl.2022.129008. Epub 2022 Sep 27. Bioorg Med Chem Lett. 2022. PMID: 36174837
202 results