Establishment of kappa opioid receptor agonists pharmacophore with molecular modeling method

Acta Pharmacologica Sinica

Volumn 19, Issue 5, 1998, Pages 445-450

  Liu, Dong Xiang ^a   Tang, Yun ^a   Jiang, Hua Liang ^a   Chen, Kai Xian ^a   Ji, Ru Yun ^a  

^a SHANGHAI INSTITUTE OF MATERIA MEDICA   (China)

Author keywords

Kappa opioid receptors; Molecular mechanics; Pharmacophore

Indexed keywords

KAPPA OPIATE RECEPTOR; KAPPA OPIATE RECEPTOR AGONIST; PD 146795; PD 146884; PD 148282; UNCLASSIFIED DRUG;

ARTICLE; BLOOD BRAIN BARRIER; CONFORMATIONAL TRANSITION; DRUG BINDING; DRUG DESIGN; DRUG RECEPTOR BINDING; DRUG SPECIFICITY; DRUG STRUCTURE; DRUG TRANSPORT; MOLECULAR MODEL;

AMINO ACID SEQUENCE; ANIMALS; DRUG DESIGN; MICE; MOLECULAR SEQUENCE DATA; MOLECULAR STRUCTURE; RECEPTORS, OPIOID, KAPPA; SEQUENCE ALIGNMENT;

EID: 0031689983     PISSN: 02539756     EISSN: None     Source Type: Journal    
DOI: None     Document Type: Article

References (11)

1. Szmvszkovicz J, Vonvoigtlander PF. Benzene acetamide amines: structurally novel non-mu opioids. J Med Chem 1982; 25:1125-6.
2. Lancaster C, Robert A. Preventing pancreatitis with 2-aminocycloaliphatic amides. US Patent 4 891 382. 1990 Jan 2.
3. Stein C, Millan MJ, Shippenberg TS, Peter K, Herz A. Peripheral opioid receptors mediating antinociception in inflammation. Evidence for involvement of mu, delta and kappa receptors. J Pharmacol Exp Ther 1989; 248:1269-75.
4. Higginbottom M, Nolan W, O'Toole J, Ratchliffe GS, Rees DC, Roberts E. The design and synthesis of kappa opioid ligands based on a binding model for kappa agonists. Bioorg Med Lett 1993; 3: 841-6.
5. Trumpp-kallmeyer S, Hoflack J, Bruinvels A, Hilbert M. Modeling of G-protein-coupled receptors: application to dopamine, adrenaline, serotonin, acetylcholine, and mammalian opsin receptors. J Med Chem 1992; 35: 3448-62.
6. Vecchietti V, Clarke GD, Colle R, Ciardina G, Petrone G, Sbacchi M. (1S)-1-(Aminomethyl)-2-(arylacetyl)-1,2,3, 4-tetrahydroisoquinoline and hetero-cycle-condensed tetrahydropyridine derivatives: members of a novel class of very potent κ opiod analgesics. J Med Chem 1991; 34: 2624-33.
7. 1 muscarinic acetylcholine receptors: conserved aspartic acids play important roles in receptor function. Mol Pharmacol 1989; 36: 840-7.
8. Dixon RAF, Strader CD, Sigal IS. Structure and function of G-protein coupled receptors. Annu Rep Med Chem 1988; 23: 221-33.
9. Cuyon C. Opiate agonist phenothiazine: synthesis and structure-activity relationship. 13th Int Symp Med Chem; 1994 Sep 19-23; Paris, France. Leiden: Escom Sci Publ. p 129.
10. De Costa BR, Radesca L, Di Paolo L, Bowen WD. Synthesis, characterization and biological evaluation of a novel class of N-(arylethyl)-N-alkyl-2-(1-pyrrolidinyl) ethylamines: structural requirements and binding affinity as the σ receptor. J Med Chem 1992; 35: 38-47.
11. De Costa BR, Dominguez C, He XS, Williams W, Radesca L, Bowen W. Synthesis and biological evaluation of conformationally restricted 2-(1-pyrrolidinyl)-N-[2-(3, 4-dichlorophenyl) ethyl]-N-methylethylene diamines as sigma receptor ligands. J Med Chem 1992; 35: 4334-43.