Search Results - "Pajeva, I."

P688: VIRTUAL SCREENING PROTOCOL TO IDENTIFY TYROSINE KINASE INHIBITORS WITH A POTENTIAL TO INTERACT WITH P‐GLYCOPROTEIN AND TO ACT AS MDR CHEMOSENSITIZERS: A VALIDATION STUDY by Beleva, E., Tsakovska, I., Alov, P., Pencheva, T., Lessigiarska, I., Pajeva, I.

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Phenothiazines and structurally related compounds as modulators of cancer multidrug resistance by Tsakovska, I, Pajeva, I

“…Phenothiazines and structurally related compounds alongside their other biological activities are able to modulate multidrug resistance (MDR) in tumor cells…”
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Structure-activity relationships of multidrug resistance reversers by Wiese, M, Pajeva, I K

“…Multidrug resistance, MDR, is a major obstacle in the chemotherapeutic treatment of cancer. MDR can be reversed by drugs that vary widely in their chemical…”
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Quantitative structure-activity relationship (QSAR) and three-dimensional QSAR analysis of a series of xanthates as inhibitors and inactivators of cytochrome P450 2B1 by Lesigiarska, I., Pajeva, I., Yanev, S.

“…1. Various xanthates (R-OCS2) were found to be mechanism-based inactivators of cytochrome P450 2B1 (CYP2B1) and CYP2B6 via formation of reactive metabolites…”
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Membrane interactions of some catamphiphilic drugs and relation to their multidrug-resistance-reversing ability by PAJEVA, I. K, WIESE, M, CORDES, H.-P, SEYDEL, J. K

“…The multidrug-resistance (MDR)-reversing ability of the catamphiphilic drugs could be mediated through their interaction with the membrane phospholipids. This…”
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AMMOS: A Software Platform to Assist in silico Screening by Pencheva, T, Lagorce, D, Pajeva, I, Villoutreix, B O, Miteva, M A

“…Three software packages based on the common platform of AMMOS (Automated Molecular Mechanics Optimization tool for in silico Screening) for assisting virtual…”
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Molecular modeling study of the multidrug resistance modifiers cis- and trans-flupentixol by Wiese, M, Pajeva, I K

“…Recent drug-membrane interaction and quantitative structure-activity relationship studies of thioxanthenes and related compounds acting as multidrug resistance…”
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3D QSAR investigation of the blood-brain barrier penetration of chemical compounds by Lessigiarska, I., Pajeva, I., Cronin, M.T.D., Worth, A.P.

“…In the present study, we investigated structure-permeability relationships for the blood-brain barrier (BBB) of 16 imipramine and phenothiazine derivatives…”
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AMMOS software: method and application by Pencheva, T, Lagorce, D, Pajeva, I, Villoutreix, B O, Miteva, M A

“…Recent advances in computational sciences enabled extensive use of in silico methods in projects at the interface between chemistry and biology. Among them…”
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Molecular modeling of triazine type MDR modulators using CoMFA and CoMSIA approaches by Tsakovska, I.M., Pajeva, I.K.

“…In the present study a series of 30 triazine derivatives was investigated by 3D QSAR methods with respect to their MDR reversing activity in vitro . Two…”
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In vivo data mining and in silico metabolic profiling to predict diverse hepatotoxic phenotypes: Case study of piperonyl butoxide by Vitcheva, V., Mostrag-Szlichtyng, A., Sacher, O., Bienfait, B., Schwab, C.H., Richarz, A., Tzakovska, I., Al Sharif, M., Pajeva, I., Yang, C.

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Data extraction module—A supplementary tool for the AMMOS_ProtLig software package by Jereva, Dessislava, Pajeva, Ilza, Pencheva, Tania

“…Data Extraction Module is a supplementary tool for the software package AMMOS_ProtLig (Automated Molecular Mechanics Optimization tool for in silicoScreening…”
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Antineoplastic activity prediction by means of a statistical-heuristic technique by Pajeva, I K

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Molecular Modeling of Phenothiazines and Related Drugs As Multidrug Resistance Modifiers:  A Comparative Molecular Field Analysis Study by Pajeva, Ilza, Wiese, Michael

“…A set of 40 phenothiazines, thioxanthenes, and structurally related drugs with multidrug resistance modulating activity in tumor cells in vitro were selected…”
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Threshold stimulation and accommodation of the Hodgkin-Huxley axon by Dimitrov, G V, Dimitrova, N A, Pajeva, I K

“…The charge-duration and strength-duration relations for just threshold rectangular stimuli were numerically investigated for the Hodgkin-Huxley axons of…”
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Structure-activity relationship investigation of bis(2-chloroethyl)aminoethyl esters of some carboxylic acids by Pajeva, I, Manolov, I, Golovinsky, E V

“…A study of quantitative structure-activity relationships (QSAR) in a series of carboxylic acid bis(2-chloroethyl)aminoethyl esters with potential antitumor…”
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Inhibition of UDP-glucuronosyltransferase by 5'-O-amino Acid and Oligopeptide Derivatives of Uridine: Structure-Activity Relationships by Naydenova, Zlatina G., Grancharov, Konstantin C., Alargov, Dimitar K., Golovinsky, Evgeny V., Stanoeva, Ivanka M., Shalamanova, Liliana D., Pajeva, Ilza K.

“…The inhibitory effect of a series of 5′-O-amino acid and oligopeptide derivatives of uridine on rat liver UDP-glucuronosyltransferase (UGT) activities was…”
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Multidrug resistance modifiers: Molecular modelling using comparative molecular field analysis by Wiese, M., Pajeva, I.

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BACOMP--database of bioactive compounds for structure-activity relationship by Pajeva, I K, Lateva, Z C, Dimitrov, G V

“…BACOMP database is presented for structure-activity relationship (SAR) investigations; it was realized on a BK-1300 general purpose microcomputer using the…”
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Pharmacophore Model of Drugs Involved in P-Glycoprotein Multidrug Resistance:  Explanation of Structural Variety (Hypothesis) by Pajeva, Ilza K, Wiese, Michael

“…A general pharmacophore model of P-glycoprotein (P-gp) drugs is proposed that is based on a highly diverse data set and relates to the verapamil binding site…”
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