Ligand-based in silico identification and biological evaluation of potential inhibitors of nicotinamide N-methyltransferase.

Kushavah, Unnati; Panigrahi, Lalita; Ahmed, Shakil; Siddiqi, Mohammad Imran

Kushavah, Unnati; Panigrahi, Lalita; Ahmed, Shakil; Siddiqi, Mohammad Imran.

Afiliación

Kushavah U; Biochemistry and Structural Biology Division, CSIR-Central Drug Research Institute, Sector 10, Jankipuram Extension, Sitapur Road, Lucknow, 226031, India.
Panigrahi L; Academy of Scientific and Innovative Research (AcSIR), CSIR-Central Drug Research Institute Campus, Lucknow, India.
Ahmed S; Biochemistry and Structural Biology Division, CSIR-Central Drug Research Institute, Sector 10, Jankipuram Extension, Sitapur Road, Lucknow, 226031, India.
Siddiqi MI; Biochemistry and Structural Biology Division, CSIR-Central Drug Research Institute, Sector 10, Jankipuram Extension, Sitapur Road, Lucknow, 226031, India.

Mol Divers ; 27(3): 1255-1269, 2023 Jun.

Article en En | MEDLINE | ID: mdl-35793051

Asunto(s)

Diabetes Mellitus Tipo 2; Nicotinamida N-Metiltransferasa; Humanos; Simulación del Acoplamiento Molecular; Nicotinamida N-Metiltransferasa/genética; Nicotinamida N-Metiltransferasa/metabolismo; Ligandos; Obesidad

Palabras clave

Ligand based design; Molecular dynamics; NNMT inhibitor; Pharmacophore model; Virtual screening

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Texto completo: 1 Colección: 01-internacional Banco de datos: MEDLINE Asunto principal: Diabetes Mellitus Tipo 2 / Nicotinamida N-Metiltransferasa Tipo de estudio: Diagnostic_studies / Prognostic_studies Límite: Humans Idioma: En Revista: Mol Divers Asunto de la revista: BIOLOGIA MOLECULAR Año: 2023 Tipo del documento: Article País de afiliación: India

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