Structural predictions of adenosine 2B antagonist affinity using molecular field analysis

Quantitative Structure-Activity Relationships

Volumn 20, Issue 1, 2001, Pages 23-30

  Song, Yuqing ^a   Coupar, Ian M ^a   Iskander, Magdy N ^a  

^a MONASH UNIVERSITY   (Australia)

Author keywords

A2B receptor antagonists; Adenosine A2B receptor; CoMFA; Pharmacophore

Indexed keywords

BIOACTIVITY; MOLECULAR MECHANICS; MOLECULAR MODELING; PHARMACODYNAMICS;

ADENOSINE 2B RECEPTOR ANTAGONIST; ADENOSINE ADENOSINE 2B RECEPTOR; ALLOXAZINES; BINDING-SITES; COMFA; MOLECULAR FIELD ANALYSIS; PHARMACOPHORE MODELS; PHARMACOPHORES; RECEPTOR ANTAGONISTS; STRUCTURAL EVALUATION;

HYDROGEN BONDS;

ADENOSINE A2B RECEPTOR; ADENOSINE RECEPTOR BLOCKING AGENT; FLAVINE MONONUCLEOTIDE;

ARTICLE; BINDING SITE; HYDROGEN BOND; LIGAND BINDING; MOLECULAR DYNAMICS; MOLECULAR INTERACTION; PREDICTION; PRIORITY JOURNAL; QUANTITATIVE STRUCTURE ACTIVITY RELATION;

EID: 0034983461     PISSN: 09318771     EISSN: None     Source Type: Journal    
DOI: 10.1002/1521-3838(200105)20:1<23::AID-QSAR23>3.0.CO;2-I     Document Type: Article

References (27)

1. 3H]NECA in rat striatal membranes
2. Adenosine receptors as potential therapeutic targets
3. Adenosine receptor subtypes
4. Adenosine receptors-new opportunities for future drugs
5. Review: Neurotransmitter receptors VII - Adenosine receptors
6. Pharmacological characterization of adenosine A2b receptors. (Studies in human mast cells co-expressing A2a and A2b adenosine receptor subtypes)
7. 2B receptors: A novel therapeutic target in asthma?
8. Adenosine a sub 2b receptors evoke interleukin-8 secretion in human mast cells: An enprofylline-sensitive mechanism with implications for asthma
9. 2B adenosine receptors
10. 2B receptor
11. Adenosine modulation of neurotransmission in penile erection
12. 2B receptors
13. Functional characterisation of the adenosine receptor mediating inhibition of intestinal secretion
14. Why are A2B receptors low-affinity adenosine receptors? mutation of Asn273 to Tyr increases affinity of human A2B receptor for 2-(1-hexynyl) adenosine
15. 3 receptor subtypes
16. 1,3-Dialkylxanthine derivatives having high potency as antagonists at human A2b adenosine receptors
17. Apparent affinity of some 8-phenyl-substituted xanthines at adenosine receptors in guinea-pig aorta and atria
18. 2B adenosine receptors
19. 2B subtype
20. 3D-QSAR: A current perspective
21. Theoretical and practical aspects of three-dimensional quantitative structure-activity relationship
22. Synthesis, CoMFA analysis, and receptor docking of 3,5-diacyl-2,4-dialkylpyridine derivatives as selective A3 adenosine receptor antagonists
23. Flavonoid derivatives as adenosine receptor antagonists: A comparison of the hypothetical receptor binding site based on a comparative molecular field analysis model
24. 2A antagonists
25. Adenosine antagonism by purines, pteridines and benzopteridines in human fibroblasts
26. 2B adenosine receptor in NIH 3T3 fibroblasts