Organic acids (OA) have been known to regulate both the availability and absorption of non-heme iron. Honey contains 0.57 % organic (OA). These prompt us carry out present study, where fifty-three selected (honey) ligands were assessed on docking behavior human Ferritin, Transferrin, Hepcidin using PatchDock method. Furthermore, Molecular physicochemical Absorption, Distribution, Metabolism, Ex...

Cancer is one of the most important diseases threatening human health today, and gastric cancer among top five in terms mortality rate. Synthesized eight isoxazole derivatives were investigated this study as computationally. Structural properties them examined detail chemical/electronic these compounds are using contour plot HOMO/LUMO molecular electrostatic potential (MEP) map. Anticancer dock...

Tyrosinase enzyme is an that plays important role in melanin synthesis. This will oxidize the amino acid L-tyrosine into L- 3,4 dihydroxyphenylalanine (L-DOPA) and convert L-DOPA DOPAquinone. protein from Bacillus megaterium complex with inhibitor kojic target interact ligand (Drug Candidate), Temulawak (Curcuma xanthorrhiza) one of medicinal plants Zingiberaceae family which widely grown used ...

Cordia dichotoma Forst. (F. Boraginaceae) has been traditionally used for the management of a variety human ailments. In our earlier work, antidiabetic activity methanolic bark extract C. (MECD) reported. this paper, two flavonoid molecules were isolated (by column chromatography) and identified IR, NMR mass spectroscopy/spectrometry) from MECD with an aim to investigate their effectiveness. Mo...

Cancer can be described as the uncontrolled growth of abnormal cells. Breast cancer is the second most common type of cancer after lung cancer. Normal breast cells and most breast cancer cells have receptors that attach to circulating estrogen and progesterone. Estrogen and progesterone bind to the receptors and may work with growth factors (e.g., oncogenes and mutated tumor suppressor genes) t...

BACKGROUND Theoretical models for predicting absorption, distribution, metabolism and excretion (ADME) properties play increasingly important roles in support of the drug development process. OBJECTIVE We briefly review the in silico prediction models for three important ADME properties, namely, aqueous solubility, human intestinal absorption, and oral bioavailability. METHODS Rather than g...

Objective(s): In the present study,a new series of 6-methoxy-2-arylquinoline analogues was designed and synthesized as P-glycoprotein (P-gp) inhibitors using quinine and flavones as the lead compounds. Materials and Methods: The cytotoxic activity of the synthesized compounds was evaluated against two human cancer cell lines including EPG85-257RDB, multidrug-resistant gastric carcinoma cells (P...

OBJECTIVE Proteins involving absorption, distribution, metabolism, and excretion (ADME) play a critical role in drug pharmacokinetics. The type and frequency of genetic variation in the ADME genes differ among populations. The aim of this study was to systematically investigate common and rare ADME coding variation in diverse ethnic populations by exome sequencing. MATERIALS AND METHODS Data ...