(S)-(+)-Nipecotic acid (BioDeep_00000754130)
代谢物信息卡片
化学式: C6H11NO2 (129.079)
中文名称: (S)-(+)-3-哌啶甲酸
谱图信息:
最多检出来源 () 0%
分子结构信息
SMILES: C1CC(CNC1)C(=O)O
InChI: InChI=1S/C6H11NO2/c8-6(9)5-2-1-3-7-4-5/h5,7H,1-4H2,(H,8,9)/t5-/m0/s1
数据库引用编号
5 个数据库交叉引用编号
- ChEBI: CHEBI:222169
- PubChem: 6575389
- DrugBank: DB08849
- ChEMBL: CHEMBL77484
- CAS: 59045-82-8
分类词条
相关代谢途径
Reactome(0)
BioCyc(0)
PlantCyc(0)
代谢反应
0 个相关的代谢反应过程信息。
Reactome(0)
BioCyc(0)
WikiPathways(0)
Plant Reactome(0)
INOH(0)
PlantCyc(0)
COVID-19 Disease Map(0)
PathBank(0)
PharmGKB(0)
0 个相关的物种来源信息
在这里通过桑基图来展示出与当前的这个代谢物在我们的BioDeep知识库中具有相关联信息的其他代谢物。在这里进行关联的信息来源主要有：
- PubMed: 来源于PubMed文献库中的文献信息，我们通过自然语言数据挖掘得到的在同一篇文献中被同时提及的相关代谢物列表，这个列表按照代谢物同时出现的文献数量降序排序，取前10个代谢物作为相关研究中关联性很高的代谢物集合展示在桑基图中。
- NCBI Taxonomy: 通过文献数据挖掘，得到的代谢物物种来源信息关联。这个关联信息同样按照出现的次数降序排序，取前10个代谢物作为高关联度的代谢物集合展示在桑吉图上。
- Chemical Taxonomy: 在物质分类上处于同一个分类集合中的其他代谢物
- Chemical Reaction: 在化学反应过程中，存在为当前代谢物相关联的生化反应过程中的反应底物或者反应产物的关联代谢物信息。
点击图上的相关代谢物的名称，可以跳转到相关代谢物的信息页面。
| 亚细胞结构定位 | 关联基因列表 |
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文献列表
- Felix Kern, Klaus T Wanner. Screening oxime libraries by means of mass spectrometry (MS) binding assays: Identification of new highly potent inhibitors to optimized inhibitors γ-aminobutyric acid transporter 1.
Bioorganic & medicinal chemistry.
2019 04; 27(7):1232-1245. doi:
10.1016/j.bmc.2019.02.015. [PMID: 30777661] - Kazuaki Nakada, Mamie Yoshikawa, Soichiro Ide, Akihiro Suemasa, Shuhei Kawamura, Takaaki Kobayashi, Eiji Masuda, Yoshihiko Ito, Wataru Hayakawa, Takahiro Katayama, Shizuo Yamada, Mitsuhiro Arisawa, Masabumi Minami, Satoshi Shuto. Cyclopropane-based conformational restriction of GABA by a stereochemical diversity-oriented strategy: identification of an efficient lead for potent inhibitors of GABA transports.
Bioorganic & medicinal chemistry.
2013 Sep; 21(17):4938-50. doi:
10.1016/j.bmc.2013.06.063. [PMID: 23886812] - Ingolf Sitka, Lars Allmendinger, Günther Fülep, Georg Höfner, Klaus T Wanner. Synthesis of N-substituted acyclic β-amino acids and their investigation as GABA uptake inhibitors.
European journal of medicinal chemistry.
2013 Jul; 65(?):487-99. doi:
10.1016/j.ejmech.2013.04.063. [PMID: 23770450] - Jörg Pabel, Mark Faust, Cornelia Prehn, Babette Wörlein, Lars Allmendinger, Georg Höfner, Klaus T Wanner. Development of an (S)-1-{2-[tris(4-methoxyphenyl)methoxy]ethyl}piperidine-3-carboxylic acid [(S)-SNAP-5114] carba analogue inhibitor for murine γ-aminobutyric acid transporter type 4.
ChemMedChem.
2012 Jul; 7(7):1245-55. doi:
10.1002/cmdc.201200126. [PMID: 22544452] - Mark R Faust, Georg Höfner, Jörg Pabel, Klaus T Wanner. Azetidine derivatives as novel gamma-aminobutyric acid uptake inhibitors: synthesis, biological evaluation, and structure-activity relationship.
European journal of medicinal chemistry.
2010 Jun; 45(6):2453-66. doi:
10.1016/j.ejmech.2010.02.029. [PMID: 20219271] - Andrea Kragler, Georg Höfner, Klaus T Wanner. Synthesis and biological evaluation of aminomethylphenol derivatives as inhibitors of the murine GABA transporters mGAT1-mGAT4.
European journal of medicinal chemistry.
2008 Nov; 43(11):2404-11. doi:
10.1016/j.ejmech.2008.01.005. [PMID: 18395300] - T G Dhar, L A Borden, S Tyagarajan, K E Smith, T A Branchek, R L Weinshank, C Gluchowski. Design, synthesis and evaluation of substituted triarylnipecotic acid derivatives as GABA uptake inhibitors: identification of a ligand with moderate affinity and selectivity for the cloned human GABA transporter GAT-3.
Journal of medicinal chemistry.
1994 Jul; 37(15):2334-42. doi:
10.1021/jm00041a012. [PMID: 8057281]
