relation: http://publicatio.bibl.u-szeged.hu/19432/ title: Multidrug resistance reversal activity of extract and a rare dimeric naphthoquinone from Diospyros lotus creator: Rauf Abdur creator: Shaheen Usama Y. creator: Raza Muslim creator: Uddin Ghias creator: Hadda, Ben Taibi creator: Mabkhot Yahia Nasser creator: Jehan Noor creator: Ahmad Bashir creator: Raza Saleem creator: Molnár József creator: Csonka Ákos creator: Szabó Diána description: A dimeric naphthoquinone namely dihydrodyspyrole R (1) was purified once more from Diospyros lotus. Dihydrodyspyrole R and chloroform fractions were evaluated for their effects on the reversion of multidrug resistance (MDR). The compounds (1) and extract exhibited promising MDR reversing effect in a dose-dependent manner against mouse T-lymphoma cell line. Molecular docking of compound 1 revealed the correlation between in-silico with in-vitro results. The molecular docking results showed that compound 1 is bind closely where co-crystal ligand of P-gp is present. But usually, computational investigation predicts that, if a compound gives lesser score then compound will exhibit good activity. Hence, the docking scores of compound 1 are the near to the Rhodamine. It is conclude that there are certain important structural features of compound 1which are responsible for the inhibiting potency of P-gp from mice. The computational Petra/Osiris/Molinspiration (POM) analysis confirms the possibility of use of compound 1 without side effect or less toxicity risks. date: 2018 type: Folyóiratcikk type: PeerReviewed format: text identifier: http://publicatio.bibl.u-szeged.hu/19432/1/3370144_MultidrugResistanceReversalActivityofextractandARareDimericNaphthoquinonefromDiospyroslotus.pdf identifier: Rauf Abdur; Shaheen Usama Y.; Raza Muslim; Uddin Ghias; Hadda, Ben Taibi; Mabkhot Yahia Nasser; Jehan Noor; Ahmad Bashir; Raza Saleem; Molnár József; Csonka Ákos; Szabó Diána: Multidrug resistance reversal activity of extract and a rare dimeric naphthoquinone from Diospyros lotus. PAKISTAN JOURNAL OF PHARMACEUTICAL SCIENCES, 31 (3). pp. 821-825. ISSN 1011-601X (2018) relation: 3370144 language: eng