Dilyana Dimova: search on Z-Library

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1

Comprehensive Analysis of Single- and Multi-Target Activity Cliffs Formed by Currently Available Bioactive Compounds

Anne M. Wassermann, Dilyana Dimova, Jürgen Bajorath

Journal:

Chemical Biology & Drug Design

Year:

2011

Language:

english

File:

PDF, 868 KB

english, 2011

2

Computational Method for the Systematic Identification of Analog Series and Key Compounds Representing Series and Their Biological Activity Profiles

Stumpfe, Dagmar, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2016

Language:

english

File:

PDF, 1.62 MB

english, 2016

3

Redundancy in two major compound databases

Yonchev, Dimitar, Dimova, Dilyana, Stumpfe, Dagmar, Vogt, Martin, Bajorath, Jürgen

Journal:

Drug Discovery Today

Year:

2018

Language:

english

File:

PDF, 467 KB

english, 2018

4

Computational Chemical Biology: Identification of Small Molecular Probes that Discriminate between Members of Target Protein Families

Dilyana Dimova, Jürgen Bajorath

Journal:

Chemical Biology & Drug Design

Year:

2012

Language:

english

File:

PDF, 545 KB

english, 2012

5

Design of multi-target activity landscapes that capture hierarchical activity cliff distributions

Dilyana Dimova, Jürgen Bajorath

Journal:

Journal of Cheminformatics

Year:

2012

Language:

english

File:

PDF, 71 KB

english, 2012

6

Assessing the Target Differentiation Potential of Imidazole-Based Protein Kinase Inhibitors

Dimova, Dilyana, Iyer, Preeti, Vogt, Martin, Totzke, Frank, Kubbutat, Michael H. G., Schächtele, Christoph, Laufer, Stefan, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2012

Language:

english

File:

PDF, 622 KB

english, 2012

7

Advances in Computational Medicinal Chemistry: Matched Molecular Pair Analysis

Wassermann, Anne Mai, Dimova, Dilyana, Iyer, Preeti, Bajorath, Jürgen

Journal:

Drug Development Research

Year:

2012

Language:

english

File:

PDF, 357 KB

english, 2012

8

Compound Pathway Model To Capture SAR Progression: Comparison of Activity Cliff-Dependent and -Independent Pathways

Stumpfe, Dagmar, Dimova, Dilyana, Heikamp, Kathrin, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2013

Language:

english

File:

PDF, 821 KB

english, 2013

9

Do Medicinal Chemists Learn from Activity Cliffs? A Systematic Evaluation of Cliff Progression in Evolving Compound Data Sets

Dimova, Dilyana, Heikamp, Kathrin, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2013

Language:

english

File:

PDF, 971 KB

english, 2013

10

Quantifying the Fingerprint Descriptor Dependence of Structure–Activity Relationship Information on a Large Scale

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2013

Language:

english

File:

PDF, 548 KB

english, 2013

11

Recent Progress in Understanding Activity Cliffs and Their Utility in Medicinal Chemistry

Stumpfe, Dagmar, Hu, Ye, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2014

Language:

english

File:

PDF, 992 KB

english, 2014

12

Large-Scale Assessment of Activity Landscape Feature Probabilities of Bioactive Compounds

Kayastha, Shilva, Dimova, Dilyana, Iyer, Preeti, Vogt, Martin, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2014

Language:

english

File:

PDF, 3.02 MB

english, 2014

13

Matched Molecular Pair Analysis of Small Molecule Microarray Data Identifies Promiscuity Cliffs and Reveals Molecular Origins of Extreme Compound Promiscuity

Dimova, Dilyana, Hu, Ye, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2012

Language:

english

File:

PDF, 2.03 MB

english, 2012

14

Navigating High-Dimensional Activity Landscapes: Design and Application of the Ligand-Target Differentiation Map

Iyer, Preeti, Dimova, Dilyana, Vogt, Martin, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2012

Language:

english

File:

PDF, 1.82 MB

english, 2012

15

Composition and Topology of Activity Cliff Clusters Formed by Bioactive Compounds

Stumpfe, Dagmar, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2014

Language:

english

File:

PDF, 2.21 MB

english, 2014

16

Method for the Evaluation of Structure–Activity Relationship Information Associated with Coordinated Activity Cliffs

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2014

Language:

english

File:

PDF, 4.61 MB

english, 2014

17

Design of Multitarget Activity Landscapes That Capture Hierarchical Activity Cliff Distributions

Dimova, Dilyana, Wawer, Mathias, Wassermann, Anne Mai, Bajorath, Jürgen

Journal:

Journal of Chemical Information and Modeling

Year:

2011

Language:

english

File:

PDF, 3.90 MB

english, 2011

18

Extraction of SAR information from activity cliff clusters via matching molecular series

Dimova, Dilyana, Bajorath, Jürgen

Journal:

European Journal of Medicinal Chemistry

Year:

2014

Language:

english

File:

PDF, 1.28 MB

english, 2014

19

Specific chemical changes leading to consistent potency increases in structurally diverse active compounds

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Year:

2014

Language:

english

File:

PDF, 789 KB

english, 2014

20

Systematic assessment of coordinated activity cliffs formed by kinase inhibitors and detailed characterization of activity cliff clusters and associated SAR information

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

European Journal of Medicinal Chemistry

Year:

2015

Language:

english

File:

PDF, 4.44 MB

english, 2015

21

Activity cliff clusters as a source of structure–activity relationship information

Dimova, Dilyana, Stumpfe, Dagmar, Hu, Ye, Bajorath, Jürgen

Journal:

Expert Opinion on Drug Discovery

Year:

2015

Language:

english

File:

PDF, 634 KB

english, 2015

22

Structural diversity and potency range distribution of scaffolds from compounds active against current pharmaceutical targets

Kayastha, Shilva, Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Future Medicinal Chemistry

Year:

2015

Language:

english

File:

PDF, 1.34 MB

english, 2015

23

Target-based analysis of ionization states of bioactive compounds

Kayastha, Shilva, de la Vega de León, Antonio, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Year:

2015

Language:

english

File:

PDF, 1.93 MB

english, 2015

24

Systematic assessment of scaffold hopping versus activity cliff formation across bioactive compound classes following a molecular hierarchy

Stumpfe, Dagmar, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Bioorganic & Medicinal Chemistry

Year:

2015

Language:

english

File:

PDF, 608 KB

english, 2015

25

Visualization of multi-property landscapes for compound selection and optimization

de la Vega de León, Antonio, Kayastha, Shilva, Dimova, Dilyana, Schultz, Thomas, Bajorath, Jürgen

Journal:

Journal of Computer-Aided Molecular Design

Year:

2015

Language:

english

File:

PDF, 1.48 MB

english, 2015

26

Monitoring the Progression of Structure–Activity Relationship Information during Lead Optimization

Shanmugasundaram, Veerabahu, Zhang, Liying, Kayastha, Shilva, de la Vega de León, Antonio, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2015

Language:

english

File:

PDF, 2.19 MB

english, 2015

27

Systematic assessment of analog relationships between bioactive compounds and promiscuity of analog sets

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Year:

2016

Language:

english

File:

PDF, 2.16 MB

english, 2016

28

Classification of matching molecular series on the basis of SAR phenotypes and structural relationships

Ghosh, Adhideb, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Year:

2016

Language:

english

File:

PDF, 4.81 MB

english, 2016

29

Systematic design of analogs of active compounds covering more than 1000 targets

Dimova, Dilyana, Bajorath, Jürgen

Journal:

Year:

2016

Language:

english

File:

PDF, 1.39 MB

english, 2016

30

One hundred ABO-incompatible kidney transplantations between 2004 and 2014: a single-centre experience

Zschiedrich, Stefan, Jänigen, Bernd, Dimova, Dilyana, Neumann, Anja, Seidl, Maximilian, Hils, Silvia, Geyer, Marcel, Emmerich, Florian, Kirste, Günter, Drognitz, Oliver, Hopt, Ulrich T., Walz, Gerd, H

Journal:

Nephrology Dialysis Transplantation

Year:

2016

File:

PDF, 331 KB

2016

31

One hundred ABO-incompatible kidney transplantations between 2004 and 2014: a single-centre experience

Zschiedrich, Stefan, Jänigen, Bernd, Dimova, Dilyana, Neumann, Anja, Seidl, Maximilian, Hils, Silvia, Geyer, Marcel, Emmerich, Florian, Kirste, Günter, Drognitz, Oliver, Hopt, Ulrich T., Walz, Gerd, H

Journal:

Nephrology Dialysis Transplantation

Year:

2016

Language:

english

File:

PDF, 331 KB

english, 2016

32

Advances in Activity Cliff Research

Dimova, Dilyana, Bajorath, Jürgen

Journal:

Molecular Informatics

Year:

2016

Language:

english

File:

PDF, 1.91 MB

english, 2016

33

Identification of Orthologous Target Pairs with Shared Active Compounds and Comparison of Organism-specific Activity Patterns

Dimova, Dilyana, Stumpfe, Dagmar, Bajorath, Jürgen

Journal:

Chemical Biology & Drug Design

Year:

2015

Language:

english

File:

PDF, 1012 KB

english, 2015

34

Highly Promiscuous Small Molecules from Biological Screening Assays Include Many Pan-Assay Interference Compounds but Also Candidates for Polypharmacology

Gilberg, Erik, Jasial, Swarit, Stumpfe, Dagmar, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Medicinal Chemistry

Year:

2016

Language:

english

File:

PDF, 1.04 MB

english, 2016

35

Analog series-based scaffolds: computational design and exploration of a new type of molecular scaffolds for medicinal chemistry

Dimova, Dilyana, Stumpfe, Dagmar, Hu, Ye, Bajorath, Jürgen

Journal:

Future Science OA

Year:

2016

Language:

english

File:

PDF, 732 KB

english, 2016

36

Identification and analysis of promiscuity cliffs formed by bioactive compounds and experimental implications

Dimova, Dilyana, Gilberg, Erik, Bajorath, Jürgen

Journal:

Year:

2017

Language:

english

File:

PDF, 2.38 MB

english, 2017

37

Systematic analysis of structural and activity relationships between conventional hierarchical and analog series-based scaffolds

Stumpfe, Dagmar, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Year:

2017

Language:

english

File:

PDF, 682 KB

english, 2017

38

Application of a New Scaffold Concept for Computational Target Deconvolution of Chemical Cancer Cell Line Screens

Kunimoto, Ryo, Dimova, Dilyana, Bajorath, Jürgen

Journal:

Year:

2017

Language:

english

File:

PDF, 882 KB

english, 2017

39

Is scaffold hopping a reliable indicator for the ability of computational methods to identify structurally diverse active compounds?

Dimova, Dilyana, Bajorath, Jürgen

Journal:

Journal of Computer-Aided Molecular Design

Year:

2017

Language:

english

File:

PDF, 801 KB

english, 2017

40

Rationalizing Promiscuity Cliffs

Dimova, Dilyana, Bajorath, Juergen

Journal:

Year:

2017

Language:

english

File:

PDF, 1.60 MB

english, 2017

41

Exploring Structural Relationships between Bioactive and Commercial Chemical Space and Developing Target Hypotheses for Compound Acquisition

Cerchia, Carmen, Dimova, Dilyana, Lavecchia, Antonio, Bajorath, Jürgen

Journal:

Year:

2017

Language:

english

File:

PDF, 1.15 MB

english, 2017

42

Collection of analog series-based scaffolds from public compound sources

Dimova, Dilyana, Bajorath, Jürgen

Journal:

Future Science OA

Year:

2018

Language:

english

File:

PDF, 339 KB

english, 2018

43

Trace elements in commonly used medicinal plants from Varna region, Bulgaria

Georgieva, Stanislava K., Georgieva, Angelika, Peteva, Zlatina, Dimova, Dilyana

Journal:

Environmental Science and Pollution Research

Year:

2020

File:

PDF, 320 KB

2020