3-[5-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-furyl]benzoic acid

• 分子结构分类: 有机化合物 - 有机杂环化合物 - 苯并噻唑类
• 英文名称: 3-[5-[(E)-(1,3-benzothiazol-2-ylhydrazono)methyl]-2-furyl]benzoic acid
• 英文别名: 3-[5-[(E)-(1,3-benzothiazol-2-ylhydrazinylidene)methyl]furan-2-yl]benzoic acid
• 化学式: C₁₉H₁₃N₃O₃S
• 分子量: 363.4
• InChiKey: OWUDGUNBNDBXHA-RGVLZGJSSA-N

计算性质

• 辛醇/水分配系数(LogP)：
  4.9
• 重原子数：
  26
• 可旋转键数：
  5
• 环数：
  4.0
• sp3杂化的碳原子比例：
  0.0
• 拓扑面积：
  116
• 氢给体数：
  2
• 氢受体数：
  7

文献信息

• METHODS AND COMPOSITIONS OF TRAIL-DEATH RECEPTOR AGONISTS/ACTIVATORS
  申请人：Srivastava Rakesh K.

  公开号：US20080214547A1

  公开（公告）日：2008-09-04

  This invention describes a series of methods and compositions for prevention and treatment of diseases such as cancer. One aspect of the invention describes small molecule-based drugs that can be used to bind to death receptors TRAIL-R1/DR4 and/or TRAIL-R2/DR5 and induce apoptosis in cancer cells, while sparing normal cells. The invention also describes TRAIL Death Receptor Agonists/Activators (DRAs) and their uses, such as the induction of apoptosis through caspase-8 and caspase-3 activation. The present invention also describes the methods of treating cancers, such as breast, prostate, colon, pancreatic, ovarian, lung, and brain cancers, leukemia, lymphoma, multiple myeloma, and mesothelioma, using DRAs either as single-agent treatments, or in combination with other therapies.
• COMPOUNDS WITH HIV-1 INTEGRASE INHIBITORY ACTIVITY AND USE THEREOF AS ANTI-HIV/AIDS THERAPEUTICS
  申请人：Neamati Nouri

  公开号：US20090088420A1

  公开（公告）日：2009-04-02

  Pharmacophore models to be used in drug design and discovery are provided. An in silico protocol and in vitro assays are presented. Compounds and their pharmaceutically acceptable salts with HIV-1 integrase inhibitory and anti-HIV activity and use thereof in the treatment of HIV/AIDS and related infections either alone or in combination with all the known antiretroviral therapeutics are described.
• US7915245B2
  申请人：——

  公开号：US7915245B2

  公开（公告）日：2011-03-29
• US8183236B2
  申请人：——

  公开号：US8183236B2

  公开（公告）日：2012-05-22
• [EN] METHODS AND COMPOSITIONS OF TRAIL-DEATH RECEPTOR AGONISTS/ACTIVATORS<br/>[FR] PROCÉDÉS ET COMPOSITIONS D'AGONISTES/ACTIVATEURS DU RÉCEPTEUR DE MORT TRAIL
  申请人：UNIV TEXAS

  公开号：WO2008094319A2

  公开（公告）日：2008-08-07

  [EN] This invention describes a series of methods and compositions for prevention and treatment of diseases such as cancer. One aspect of the invention describes small molecule- based drugs that can be used to bind to death receptors TRAIL-R 1/DR4 and/or TRAIL- R2/DR5 and induce apoptosis in cancer cells, while sparing normal cells. The invention also describes TRAIL Death Receptor Agonists/Activators (DRAs) and their uses, such as the induction of apoptosis through caspase-8 and caspase-3 activation. The present invention also describes the methods of treating cancers, such as breast, prostate, colon, pancreatic, ovarian, lung, and brain cancers, leukemia, lymphoma, multiple myeloma, and mesothelioma, using DRAs either as single-agent treatments, or in combination with other therapies.
  [FR] L'invention concerne une série de procédés et de compositions pour prévenir et traiter des maladies telles que le cancer. Un aspect de l'invention décrit des médicaments à base de petites molécules qui peuvent être utilisés pour créer une liaison avec les récepteurs de mort TRAIL-R1/DR4 et/ou TRAIL-R2/DR5, et pour induire une apoptose dans des cellules cancéreuses, tout en épargnant les cellules saines. L'invention concerne également des agonistes/activateurs du récepteur de mort TRAIL (DRA) et leurs utilisations, telles que l'induction d'une apoptose par l'intermédiaire d'une activation de la caspase-8 et de la caspase-3. La présente invention concerne également les procédés de traitement de cancers, tels que le cancer du sein, de la prostate, du côlon, du pancréas, de l'ovaire, du poumon et du cerveau, ainsi que le traitement de la leucémie, du lymphome, du myélome multiple et du mésothéliome, en utilisant des DRA comme traitements par agent unique ou en combinaison avec d'autres thérapies.