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Items: 1 to 50 of 178

1.

Structure-Activity Relationships and Computational Investigations into the Development of Potent and Balanced Dual-Acting Butyrylcholinesterase Inhibitors and Human Cannabinoid Receptor 2 Ligands with Pro-Cognitive in Vivo Profiles.

Dolles D, Hoffmann M, Gunesch S, Marinelli O, Möller J, Santoni G, Chatonnet A, Lohse MJ, Wittmann HJ, Strasser A, Nabissi M, Maurice T, Decker M.

J Med Chem. 2018 Feb 22;61(4):1646-1663. doi: 10.1021/acs.jmedchem.7b01760. Epub 2018 Feb 5.

PMID:
29400965
2.

Binding Kinetics and Pathways of Ligands to GPCRs.

Strasser A, Wittmann HJ, Seifert R.

Trends Pharmacol Sci. 2017 Aug;38(8):717-732. doi: 10.1016/j.tips.2017.05.005. Epub 2017 Jun 20. Review.

PMID:
28645833
3.

Competitive association binding kinetic assays: a new tool to detect two different binding orientations of a ligand to its target protein under distinct conditions?

Wittmann HJ, Strasser A.

Naunyn Schmiedebergs Arch Pharmacol. 2017 Jun;390(6):595-612. doi: 10.1007/s00210-017-1362-7. Epub 2017 Feb 20.

PMID:
28220211
4.

Molecular Modelling Approaches for the Analysis of Histamine Receptors and Their Interaction with Ligands.

Strasser A, Wittmann HJ.

Handb Exp Pharmacol. 2017;241:31-61. doi: 10.1007/164_2016_113. Review.

PMID:
28110354
5.

Dibenzo[b,f][1,4]oxazepines and dibenzo[b,e]oxepines: Influence of the chlorine substitution pattern on the pharmacology at the H1R, H4R, 5-HT2AR and other selected GPCRs.

Naporra F, Gobleder S, Wittmann HJ, Spindler J, Bodensteiner M, Bernhardt G, Hübner H, Gmeiner P, Elz S, Strasser A.

Pharmacol Res. 2016 Nov;113(Pt A):610-625. doi: 10.1016/j.phrs.2016.09.042. Epub 2016 Sep 30.

PMID:
27697645
6.

Conformational Restriction and Enantioseparation Increase Potency and Selectivity of Cyanoguanidine-Type Histamine H4 Receptor Agonists.

Geyer R, Nordemann U, Strasser A, Wittmann HJ, Buschauer A.

J Med Chem. 2016 Apr 14;59(7):3452-70. doi: 10.1021/acs.jmedchem.6b00120. Epub 2016 Apr 5.

PMID:
27007611
7.

The Combination of DNA Ploidy Status and PTEN/6q15 Deletions Provides Strong and Independent Prognostic Information in Prostate Cancer.

Lennartz M, Minner S, Brasch S, Wittmann H, Paterna L, Angermeier K, Öztürk E, Shihada R, Ruge M, Kluth M, Koop C, Wilczak W, Krech T, Lebok P, Wittmer C, Heinzer H, Steuber T, Adam M, Huland H, Graefen M, Haese A, Simon R, Sauter G, Schlomm T.

Clin Cancer Res. 2016 Jun 1;22(11):2802-11. doi: 10.1158/1078-0432.CCR-15-0635. Epub 2016 Jan 26.

8.

2,4-Diaminopyrimidines as dual ligands at the histamine H1 and H4 receptor-H1/H4-receptor selectivity.

Hammer SG, Gobleder S, Naporra F, Wittmann HJ, Elz S, Heinrich MR, Strasser A.

Bioorg Med Chem Lett. 2016 Jan 15;26(2):292-300. doi: 10.1016/j.bmcl.2015.12.035. Epub 2015 Dec 11.

PMID:
26718844
9.

Aminobenzimidazoles and Structural Isomers as Templates for Dual-Acting Butyrylcholinesterase Inhibitors and hCB2 R Ligands To Combat Neurodegenerative Disorders.

Dolles D, Nimczick M, Scheiner M, Ramler J, Stadtmüller P, Sawatzky E, Drakopoulos A, Sotriffer C, Wittmann HJ, Strasser A, Decker M.

ChemMedChem. 2016 Jun 20;11(12):1270-83. doi: 10.1002/cmdc.201500418. Epub 2015 Nov 9.

PMID:
26548365
10.

Structure-Dependent Deconjugation of Flavonoid Glucuronides by Human β-Glucuronidase - In Vitro and In Silico Analyses.

Untergehrer M, Bücherl D, Wittmann HJ, Strasser A, Heilmann J, Jürgenliemk G.

Planta Med. 2015 Aug;81(12-13):1182-9. doi: 10.1055/s-0035-1545980. Epub 2015 May 27.

PMID:
26018917
11.

Binding pathway of histamine to the hH4R, observed by unconstrained molecular dynamics.

Wittmann HJ, Strasser A.

Bioorg Med Chem Lett. 2015 Mar 15;25(6):1259-68. doi: 10.1016/j.bmcl.2015.01.052. Epub 2015 Jan 29.

PMID:
25677665
12.

Oxytocin receptor gene methylation: converging multilevel evidence for a role in social anxiety.

Ziegler C, Dannlowski U, Bräuer D, Stevens S, Laeger I, Wittmann H, Kugel H, Dobel C, Hurlemann R, Reif A, Lesch KP, Heindel W, Kirschbaum C, Arolt V, Gerlach AL, Hoyer J, Deckert J, Zwanzger P, Domschke K.

Neuropsychopharmacology. 2015 May;40(6):1528-38. doi: 10.1038/npp.2015.2. Epub 2015 Jan 7.

13.

Mathematical analysis of the sodium sensitivity of the human histamine H3 receptor.

Wittmann HJ, Seifert R, Strasser A.

In Silico Pharmacol. 2014 Dec;2(1):1. doi: 10.1186/s40203-014-0001-y. Epub 2014 May 24.

14.

Modulation of GPCRs by monovalent cations and anions.

Strasser A, Wittmann HJ, Schneider EH, Seifert R.

Naunyn Schmiedebergs Arch Pharmacol. 2015 Mar;388(3):363-80. doi: 10.1007/s00210-014-1073-2. Epub 2014 Nov 30. Review.

PMID:
25432095
15.

Sodium binding to hH3R and hH 4R--a molecular modeling study.

Wittmann HJ, Seifert R, Strasser A.

J Mol Model. 2014 Aug;20(8):2394. doi: 10.1007/s00894-014-2394-2. Epub 2014 Aug 7.

PMID:
25098339
16.

Synthesis, biological evaluation, and computational studies of Tri- and tetracyclic nitrogen-bridgehead compounds as potent dual-acting AChE inhibitors and hH3 receptor antagonists.

Darras FH, Pockes S, Huang G, Wehle S, Strasser A, Wittmann HJ, Nimczick M, Sotriffer CA, Decker M.

ACS Chem Neurosci. 2014 Mar 19;5(3):225-42. doi: 10.1021/cn4002126. Epub 2014 Jan 14.

17.

Pharmacological profile of astemizole-derived compounds at the histamine H1 and H4 receptor--H1/H4 receptor selectivity.

Wagner E, Wittmann HJ, Elz S, Strasser A.

Naunyn Schmiedebergs Arch Pharmacol. 2014 Mar;387(3):235-50. doi: 10.1007/s00210-013-0926-4. Epub 2013 Nov 17.

PMID:
24241585
18.

Molecular modeling studies give hint for the existence of a symmetric hβ₂R-Gαβγ-homodimer.

Straßer A, Wittmann HJ.

J Mol Model. 2013 Oct;19(10):4443-57. doi: 10.1007/s00894-013-1923-8. Epub 2013 Aug 8.

PMID:
23925512
19.

Species-dependent activities of G-protein-coupled receptor ligands: lessons from histamine receptor orthologs.

Strasser A, Wittmann HJ, Buschauer A, Schneider EH, Seifert R.

Trends Pharmacol Sci. 2013 Jan;34(1):13-32. doi: 10.1016/j.tips.2012.10.004. Epub 2012 Dec 8. Review.

PMID:
23228711
20.

Fatal aconitine intoxication or thyroid storm? A case report.

Arlt EM, Keller T, Wittmann H, Monticelli F.

Leg Med (Tokyo). 2012 May;14(3):154-6. doi: 10.1016/j.legalmed.2012.01.003. Epub 2012 Feb 16.

PMID:
22342148
21.

hβ2R-Gαs complex: prediction versus crystal structure--how valuable are predictions based on molecular modeling studies?

Straßer A, Wittmann HJ.

J Mol Model. 2012 Jul;18(7):3439-44. doi: 10.1007/s00894-011-1305-z. Epub 2011 Dec 6.

PMID:
22143581
22.

Nanofibers resulting from cooperative electrostatic and hydrophobic interactions between peptides and polyelectrolytes of opposite charge.

Ferstl M, Strasser A, Wittmann HJ, Drechsler M, Rischer M, Engel J, Goepferich A.

Langmuir. 2011 Dec 6;27(23):14450-9. doi: 10.1021/la202252m. Epub 2011 Nov 10.

PMID:
21999929
23.

Mepyramine-JNJ7777120-hybrid compounds show high affinity to hH(1)R, but low affinity to hH(4)R.

Wagner E, Wittmann HJ, Elz S, Strasser A.

Bioorg Med Chem Lett. 2011 Nov 1;21(21):6274-80. doi: 10.1016/j.bmcl.2011.09.001. Epub 2011 Sep 8.

PMID:
21944853
24.

Influence of the N-terminus and the E2-loop onto the binding kinetics of the antagonist mepyramine and the partial agonist phenoprodifen to H(1)R.

Wittmann HJ, Seifert R, Strasser A.

Biochem Pharmacol. 2011 Dec 15;82(12):1910-8. doi: 10.1016/j.bcp.2011.09.005. Epub 2011 Sep 16.

PMID:
21933664
25.

N (α)-Methylated phenylhistamines exhibit affinity to the hH(4)R-a pharmacological and molecular modelling study.

Wittmann HJ, Elz S, Seifert R, Straber A.

Naunyn Schmiedebergs Arch Pharmacol. 2011 Sep;384(3):287-99. doi: 10.1007/s00210-011-0671-5. Epub 2011 Jul 29.

PMID:
21800095
26.

In silico analysis of the histaprodifen induced activation pathway of the guinea-pig histamine H(1)-receptor.

Strasser A, Wittmann HJ.

J Comput Aided Mol Des. 2010 Sep;24(9):759-69. doi: 10.1007/s10822-010-9372-2. Epub 2010 Jul 7.

PMID:
20607589
27.

3D-QSAR CoMFA Study to Predict Orientation of Suprahistaprodifens and Phenoprodifens in the Binding-Pocket of Four Histamine H1 -Receptor Species.

Straßer A, Wittmann HJ.

Mol Inform. 2010 Apr 12;29(4):333-41. doi: 10.1002/minf.200900036. Epub 2010 Apr 12.

PMID:
27463060
28.

Distinct interactions between the human adrenergic beta(2) receptor and Galpha(s)--an in silico study.

Strasser A, Wittmann HJ.

J Mol Model. 2010 Aug;16(8):1307-18. doi: 10.1007/s00894-010-0646-3. Epub 2010 Jan 30.

PMID:
20119640
29.

Contribution of binding enthalpy and entropy to affinity of antagonist and agonist binding at human and guinea pig histamine H(1)-receptor.

Wittmann HJ, Seifert R, Strasser A.

Mol Pharmacol. 2009 Jul;76(1):25-37. doi: 10.1124/mol.109.055384. Epub 2009 Apr 3.

PMID:
19346300
30.

Molecular basis for the selective interaction of synthetic agonists with the human histamine H1-receptor compared with the guinea pig H1-receptor.

Strasser A, Wittmann HJ, Kunze M, Elz S, Seifert R.

Mol Pharmacol. 2009 Mar;75(3):454-65. doi: 10.1124/mol.108.053009. Epub 2008 Dec 1.

PMID:
19047480
31.

Ligand-specific contribution of the N terminus and E2-loop to pharmacological properties of the histamine H1-receptor.

Strasser A, Wittmann HJ, Seifert R.

J Pharmacol Exp Ther. 2008 Sep;326(3):783-91. doi: 10.1124/jpet.108.140913. Epub 2008 Jun 24.

PMID:
18577700
32.

Pharmacological profile of histaprodifens at four recombinant histamine H1 receptor species isoforms.

Strasser A, Striegl B, Wittmann HJ, Seifert R.

J Pharmacol Exp Ther. 2008 Jan;324(1):60-71. Epub 2007 Oct 10.

PMID:
17928567
33.

Analysis of the activation mechanism of the guinea-pig Histamine H1-receptor.

Strasser A, Wittmann HJ.

J Comput Aided Mol Des. 2007 Sep;21(9):499-509. Epub 2007 Aug 22.

PMID:
17712599
34.

LigPath: a module for predictive calculation of a ligand's pathway into a receptor-application to the gpH1-receptor.

Strasser A, Wittmann HJ.

J Mol Model. 2007 Jan;13(1):209-18. Epub 2006 Sep 20.

PMID:
17024405
35.

Role of cytochrome P450 2E1 in the metabolism of 1,1,2,3,3,3-hexafluoropropyl methyl ether.

Köster U, Speerschneider P, Kerssebaum R, Wittmann H, Dekant W.

Drug Metab Dispos. 1994 Sep-Oct;22(5):667-72.

PMID:
7835215
36.
37.
38.

Characterization and preliminary crystallographic studies on large ribosomal subunits from Thermus thermophilus.

Volkmann N, Hottenträger S, Hansen HA, Zayzsev-Bashan A, Sharon R, Berkovitch-Yellin Z, Yonath A, Wittmann HG.

J Mol Biol. 1990 Nov 20;216(2):239-41.

PMID:
2254927
39.

Low-resolution models for ribosomal particles reconstructed from electron micrographs of tilted two-dimensional sheets.

Berkovitch-Yellin Z, Wittmann HG, Yonath A.

Acta Crystallogr B. 1990 Oct 1;46 ( Pt 5):637-43.

PMID:
1701090
40.

Crystals of complexes mimicking protein biosynthesis are suitable for crystallographic studies.

Hansen HA, Volkmann N, Piefke J, Glotz C, Weinstein S, Makowski I, Meyer S, Wittmann HG, Yonath A.

Biochim Biophys Acta. 1990 Aug 27;1050(1-3):1-7.

PMID:
2207134
41.

Novel procedures for derivatization of ribosomes for crystallographic studies.

Weinstein S, Jahn W, Hansen H, Wittmann HG, Yonath A.

J Biol Chem. 1989 Nov 15;264(32):19138-42.

42.

Challenging the three-dimensional structure of ribosomes.

Yonath A, Wittmann HG.

Trends Biochem Sci. 1989 Aug;14(8):329-35. Review.

PMID:
2678631
43.

Cryocrystallography of ribosomal particles.

Hope H, Frolow F, von Böhlen K, Makowski I, Kratky C, Halfon Y, Danz H, Webster P, Bartels KS, Wittmann HG, et al.

Acta Crystallogr B. 1989 Apr 1;45 ( Pt 2):190-9.

PMID:
2619959
44.

Crystals of wild-type, mutated, derivatized and complexed 50 S ribosomal subunits from Bacillus stearothermophilus suitable for X-ray analysis.

Müssig J, Makowski I, von Böhlen K, Hansen H, Bartels KS, Wittmann HG, Yonath A.

J Mol Biol. 1989 Feb 5;205(3):619-21.

PMID:
2467005
45.

[Ribosomes and protein biosynthesis].

Wittmann HG.

Biol Chem Hoppe Seyler. 1989 Feb;370(2):87-99. Review. German. No abstract available.

PMID:
2650704
46.

Characterization of crystals of small ribosomal subunits.

Yonath A, Glotz C, Gewitz HS, Bartels KS, von Böhlen K, Makowski I, Wittmann HG.

J Mol Biol. 1988 Oct 5;203(3):831-4.

PMID:
3210235
47.

Two-dimensional crystalline sheets of Bacillus stearothermophilus 50S ribosomal subunits containing a nascent polypeptide chain.

Gewitz HS, Glotz C, Piefke J, Yonath A, Wittmann HG.

Biochimie. 1988 May;70(5):645-8.

PMID:
3139083
48.

Approaching the molecular structure of ribosomes.

Yonath A, Wittmann HG.

Biophys Chem. 1988 Feb;29(1-2):17-29.

PMID:
3359000
49.

Crystallographic and image reconstruction studies on ribosomal particles from bacterial sources.

Yonath A, Wittmann HG.

Methods Enzymol. 1988;164:95-117. No abstract available.

PMID:
3071693
50.

The growth of ordered two-dimensional sheets of ribosomal particles from salt-alcohol mixtures.

Arad T, Piefke J, Gewitz HS, Romberg B, Glotz C, Müssig J, Yonath A, Wittmann HG.

Anal Biochem. 1987 Nov 15;167(1):113-7.

PMID:
3434787

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