Molecular Modeling of µ Opioid Receptor Ligands with Various Functional Properties: PZM21, SR-17018, Morphine, and Fentanyl-Simulated Interaction Patterns Confronted with Experimental Data.

Podlewska, Sabina; Bugno, Ryszard; Kudla, Lucja; Bojarski, Andrzej J; Przewlocki, Ryszard

Podlewska, Sabina; Bugno, Ryszard; Kudla, Lucja; Bojarski, Andrzej J; Przewlocki, Ryszard.

Affiliation

Podlewska S; Department of Technology and Biotechnology of Drugs, Jagiellonian University Medical College, 9 Medyczna Street, 30-688 Cracow, Poland.
Bugno R; Maj Institute of Pharmacology, Polish Academy of Sciences, 12 Smetna Street, 31-343 Cracow, Poland.
Kudla L; Maj Institute of Pharmacology, Polish Academy of Sciences, 12 Smetna Street, 31-343 Cracow, Poland.
Bojarski AJ; Maj Institute of Pharmacology, Polish Academy of Sciences, 12 Smetna Street, 31-343 Cracow, Poland.
Przewlocki R; Maj Institute of Pharmacology, Polish Academy of Sciences, 12 Smetna Street, 31-343 Cracow, Poland.

Molecules ; 25(20)2020 Oct 12.

Article in En | MEDLINE | ID: mdl-33053718

Subject(s)

Morphine/chemistry; Receptors, Opioid/metabolism; Animals; Fentanyl/chemistry; Fentanyl/metabolism; Humans; Molecular Dynamics Simulation; Receptors, Opioid/chemistry; Thiophenes/chemistry; Urea/analogs & derivatives; Urea/chemistry

Key words

PZM21; SR-17018; biased agonists; docking; fentanyl; interaction fingerprints; molecular dynamics; morphine; µ opioid receptor

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Full text: 1 Collection: 01-internacional Database: MEDLINE Main subject: Receptors, Opioid / Morphine Limits: Animals / Humans Language: En Journal: Molecules Journal subject: BIOLOGIA Year: 2020 Type: Article Affiliation country: Poland

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