Advanced biological and chemical discovery (ABCD): Centralizing discovery knowledge in an inherently decentralized world

被引:62
作者
Agrafiotis, Dimitris K.
Alex, Simson
Dai, Heng
Derkinderen, An
Farnum, Michael
Gates, Peter
Izrailev, Sergei
Jaeger, Edward P.
Konstant, Paul
Leung, Albert
Lobanov, Victor S.
Marichal, Patrick
Martin, Douglas
Rassokhin, Dmitrii N.
Shemanarev, Maxim
Skalkin, Andrew
Stong, John
Tabruyn, Tom
Vermeiren, Marleen
Wan, Jackson
Xu, Xiang Yang
Yao, Xiang
机构
[1] Johnson & Johnson Pharmaceut Res & Dev LLC, Exton, PA 19341 USA
[2] Johnson & Johnson Pharmaceut Res & Dev, Div Janssen Pharmaceut NV, B-2340 Beerse, Belgium
[3] Johnson & Johnson Pharmaceut Res & Dev LLC, San Diego, CA 92121 USA
关键词
D O I
10.1021/ci700267w
中图分类号
R914 [药物化学];
学科分类号
100701 ;
摘要
We present ABCD, an integrated drug discovery informatics platform developed at Johnson & Johnson Pharmaceutical Research & Development, L.L.C. ABCD is an attempt to bridge multiple continents, data systems, and cultures using modern information technology and to provide scientists with tools that allow them to analyze multifactorial SAR and make informed, data-driven decisions. The system consists of three major components: (1) a data warehouse, which combines data from multiple chemical and pharmacological transactional databases, designed for supreme query performance; (2) a state-of-the-art application suite, which facilitates data upload, retrieval, mining, and reporting, and (3) a workspace, which facilitates collaboration and data sharing by allowing users to share queries, templates, results, and reports across project teams, campuses, and other organizational units. Chemical intelligence, performance, and analytical sophistication lie at the heart of the new system, which was developed entirely in-house. ABCD is used routinely by more than 1000 scientists around the world and is rapidly expanding into other functional areas within the J&J organization.
引用
收藏
页码:1999 / 2014
页数:16
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