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    COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE
    4.
    发明申请
    COMPOUNDS USEFUL AS INHIBITORS OF ATR KINASE 审中-公开
    化合物作为ATR激酶的抑制剂有用

    公开(公告)号：WO2014143242A8

    公开(公告)日：2015-03-05

    申请号：PCT/US2013073477

    申请日：2013-12-06

    Applicant: VERTEX PHARMA

    Inventor： CHARRIER JEAN-DAMIEN ,  DAVIS CHRIS ,  DURRANT STEVEN ,  FRAYSSE DAMIEN ,  JIMENEZ JUAN-MIGUEL ,  KAY DAVE ,  KNEGTEL RONALD ,  O'DONNELL MICHAEL ,  PIERARD FRANCOISE ,  PINDER JOANNE ,  STORCK PIERRE-HENRI ,  TWIN HEATHER

    IPC: C07D487/04 ,  A61K31/437 ,  A61P35/00

    CPC classification number: C07D487/04 ,  A61K31/437 ,  C07D491/107 ,  C07D519/00

    Abstract: The present invention relates to compounds useful as inhibitors of ATR protein kinase. The invention also relates to pharmaceutically acceptable compositions comprising the compounds of this invention; methods of treating of various diseases, disorders, and conditions using the compounds of this invention; processes for preparing the compounds of this invention; intermediates for the preparation of the compounds of this invention; and methods of using the compounds in in vitro applications, such as the study of kinases in biological and pathological phenomena; the study of intracellular signal transduction pathways mediated by such kinases; and the comparative evaluation of new kinase inhibitors. The compounds of this invention have formula (I); or a pharmaceutically acceptable salt, wherein the variables R1, R2, R3, and R4 are as defined herein.

    Abstract translation: 本发明涉及可用作ATR蛋白激酶抑制剂的化合物。 本发明还涉及包含本发明化合物的药学上可接受的组合物; 使用本发明化合物治疗各种疾病，病症和病症的方法; 制备本发明化合物的方法; 用于制备本发明化合物的中间体; 以及在体外应用中使用化合物的方法，如生物和病理现象中激酶的研究; 由这种激酶介导的细胞内信号转导途径的研究; 和新型激酶抑制剂的比较评估。 本发明化合物具有式（I）; 或其药学上可接受的盐，其中变量R1，R2，R3和R4如本文所定义。

    CRYSTAL STRUCTURE OF INTERLEUKIN-2 TYROSINE KINASE (ITK) AND BINDING POCKETS THEREOF
    6.
    发明申请
    CRYSTAL STRUCTURE OF INTERLEUKIN-2 TYROSINE KINASE (ITK) AND BINDING POCKETS THEREOF 审中-公开
    白细胞介素-2酪氨酸激酶（ITK）的结晶结构及其结合口袋

    公开(公告)号：WO2005056785A3

    公开(公告)日：2005-10-06

    申请号：PCT/US2004040689

    申请日：2004-12-03

    Applicant: VERTEX PHARMA ,  CHEETHAM GRAHAM ,  BROWN KIERON ,  KNEGTEL RONALD ,  RENWICK SUZANNE ,  VIAL SARAH

    Inventor： CHEETHAM GRAHAM ,  BROWN KIERON ,  KNEGTEL RONALD ,  RENWICK SUZANNE ,  VIAL SARAH

    IPC: C12N9/12 ,  G06F19/00 ,  C07K14/71

    CPC classification number: C12N9/1205 ,  C07K2299/00 ,  G06F19/16

    Abstract: The invention relates to molecules or molecular complexes which comprise binding pockets of ITK or its structural homologues. The invention relates to crystallizable compositions and crystals comprising ITK. The present invention also relates to a data storage medium encoded with the structural coordinates of molecules and molecular complexes which comprise the ITK or ITK-like ATP-binding pockets. The present invention also relates to a computer comprising such data storage material. The computer may generate a three-dimensional structure or graphical three-dimensional representation of such molecules or molecular complexes. This invention also relates to methods of using the structure coordinates to solve the structure of homologous proteins or protein complexes. In addition, this invention relates to methods of using the structure coordinates to screen for and design compounds, including inhibitory compounds, that bind to ITK or homologues thereof.

    Abstract translation: 本发明涉及包含ITK或其结构同系物的结合袋的分子或分子复合物。 本发明涉及包含ITK的可结晶组合物和晶体。 本发明还涉及用包含ITK或ITK样ATP结合袋的分子和分子复合物的结构坐标编码的数据存储介质。 本发明还涉及包括这种数据存储材料的计算机。 计算机可以产生这种分子或分子复合物的三维结构或图形三维表示。 本发明还涉及使用结构坐标来解决同源蛋白质或蛋白质复合物的结构的方法。 此外，本发明涉及使用结构坐标来筛选和设计与ITK或其同源物结合的化合物（包括抑制性化合物）的方法。

    CRYSTAL STRUCTURE OF AURORA-2 PROTEIN AND BINDING POCKETS THEREOF
    7.
    发明申请
    CRYSTAL STRUCTURE OF AURORA-2 PROTEIN AND BINDING POCKETS THEREOF 审中-公开
    AURORA-2蛋白质的结晶结构及其结合点

    公开(公告)号：WO03092607B1

    公开(公告)日：2004-05-13

    申请号：PCT/US0313605

    申请日：2003-05-01

    Applicant: VERTEX PHARMA ,  CHEETHAM GRAHAM ,  KNEGTEL RONALD ,  SWENSON LOVORKA ,  COLL JOYCE T ,  RENWICK SUZANNE ,  WEBER PETER

    Inventor： CHEETHAM GRAHAM ,  KNEGTEL RONALD ,  SWENSON LOVORKA ,  COLL JOYCE T ,  RENWICK SUZANNE ,  WEBER PETER

    IPC: C12N9/12 ,  A61K31/517 ,  C07D401/14 ,  C07D403/12 ,  C07D417/12

    CPC classification number: C12N9/1205 ,  C07K2299/00

    Abstract: The present invention provides crystalline molecules or molecular complexes which comprise binding pockets of Aurora-2 or its homologues. The invention also provides crystals comprising Aurora-2. The present invention also relates to a computer comprising a data storage medium encoded with the structural coordinates of Aurora-2 binding pockets and methods of using a computer to evaluate the ability of a compound to bind to the molecule or molecular complex. This invention also provides methods of using the structure coordinates to solve the structure of homologous proteins or protein complexes. In addition, this invention provides methods of using the structure coordinates to screen for and design compounds, including inhibitory compounds, that bind to Aurora-2 or homologues thereof.

    Abstract translation: 本发明提供包含Aurora-2或其同系物的结合口袋的结晶分子或分子复合物。 本发明还提供了包含Aurora-2的晶体。 本发明还涉及包含用Aurora-2结合口袋的结构座标编码的数据存储介质的计算机，以及使用计算机评价化合物结合分子或分子复合物的能力的方法。 本发明还提供了使用结构坐标来解决同源蛋白质或蛋白质复合物的结构的方法。 此外，本发明提供了使用结构坐标筛选和设计结合Aurora-2或其同系物的化合物（包括抑制性化合物）的方法。

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