Structure-based de novo design of ligands using a three-dimensional model of the insulin receptor

被引：17

作者：

Tan, C

Wei, LH

Ottensmeyer, FP

Goldfine, I

Maddux, BA

Yip, CC

Batey, RA

Kotra, LP

机构：

[1] Univ Toronto, Mol Design & Informat Technol Ctr, Toronto, ON, Canada

[2] Univ Toronto, Dept Chem, Davenport Res Labs, Toronto, ON M5S 1A1, Canada

[3] Univ Toronto, Leslie Dan Fac Pharm, Dept Pharmaceut Sci, Toronto, ON, Canada

[4] Princess Margaret Hosp, Ontario Canc Inst, Toronto, ON M4X 1K9, Canada

[5] Univ Toronto, Banting & Best Dept Med Res, Toronto, ON, Canada

[6] Univ Calif San Francisco, San Francisco, CA 94143 USA

来源：

BIOORGANIC & MEDICINAL CHEMISTRY LETTERS | 2004年 / 14卷 / 06期

基金：

加拿大健康研究院;

关键词：

insulin receptor; de novo ligand deign;

D O I：

10.1016/j.bmcl.2004.01.064

中图分类号：

R914 [药物化学];

学科分类号：

100701 ;

摘要：

For the first time, a three-dimensional model of the insulin receptor is used in the de novo design of novel ligands that potentially mimic interactions of insulin at its receptor. Compound 4 competed with insulin as seen in autophosphorylation assays and inhibited up to 68% of IR autophosphorylation at 300 muM of 4 in 3T3IR cells induced by 1 nM insulin. This model provides a basis for the design of potent insulin receptor ligands. (C) 2004 Elsevier Ltd. All rights reserved.

引用

页码：1407 / 1410

页数：4

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