Pharmacophore Design for Anti-inflammatory Agent Targeting Interleukin-2 Inducible Tyrosine Kinase (Itk) | Zendy

C. Meganathan | Zendy; Sugunadevi Sakkiah | Zendy; Sundarapandian Thangapandian | Zendy; N. Sundaraganesan | Zendy; Hyong-Ha Kim | Zendy; YongSeong Kim | Zendy; KeunWoo Lee | Zendy

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Pharmacophore Design for Anti-inflammatory Agent Targeting Interleukin-2 Inducible Tyrosine Kinase (Itk)

Author(s) -

C. Meganathan,

Sugunadevi Sakkiah,

Sundarapandian Thangapandian,

N. Sundaraganesan,

Hyong-Ha Kim,

YongSeong Kim,

KeunWoo Lee

Publication year - 2010

Publication title -

bulletin of the korean chemical society

Language(s) - English

Resource type - Journals

SCImago Journal Rank - 0.237

H-Index - 59

eISSN - 1229-5949

pISSN - 0253-2964

DOI - 10.5012/bkcs.2010.31.11.3333

Subject(s) - pharmacophore , decoy , virtual screening , drug discovery , ring (chemistry) , combinatorial chemistry , chemistry , small molecule , computational biology , tyrosine kinase , molecule , stereochemistry , pharmacology , biochemistry , medicine , biology , signal transduction , organic chemistry , receptor

A three dimensional pharmacophore model was generated for the molecules which are responsible for anti-inflamma-tory activities targeting Interleukin-2 inducible tyrosine kinase (Itk). 16 structurally diverse molecules were selected as training set to generate the hypotheses using Discovery Studio v2.1. The best hypothesis,

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