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Volumn 303, Issue 5665, 2004, Pages 1810-1813

Organic Chemistry in Drug Discovery

Author keywords

[No Author keywords available]

Indexed keywords

BIOMEDICAL ENGINEERING; DATA REDUCTION; METABOLISM; TOXICITY;

EID: 1642294294     PISSN: 00368075     EISSN: None     Source Type: Journal    
DOI: 10.1126/science.1096800     Document Type: Review
Times cited : (112)

References (17)
  • 1
    • 1642338672 scopus 로고    scopus 로고
    • note
    • In this discussion, a "hit" is defined as a nonoptimized structure obtained from some screening process on a target protein. It is often a very weak binder and is likely to have a nonoptimized pharmacokinetic profile. A "Lead" is defined as a structure that has been derived from an early "hit" and, although still not fully optimized, has been shown to have some appropriate characteristics to be a precursor of a drug entity. Often a good lead will have shown some proof-of-concept activity in an in vivo pharmacological model, but will likely not have been fully optimized for pharmacokinetic properties or undesirable off-target activities.
  • 3
    • 1642400344 scopus 로고    scopus 로고
    • note
    • In the discovery setting, the rule of five (2) predicts that poor absorption or permeation of drugs is more likely when a drug molecule possesses either (i) more than 5 hydrogen bond donors, (ii) 10 hydrogen bond acceptors, (iii) a molecular weight greater than 500, or (iv) a calculated logP greater than 5.
  • 6
    • 1642384280 scopus 로고    scopus 로고
    • note
    • See (17) for an excellent review of the cardiovascular effects manifested by QT interval prolongation and the evaluation of drug candidates for this parameter.
  • 7
    • 1642280142 scopus 로고    scopus 로고
    • See the cover story in Drug Discov. Dev. 6, 30 (2003).
    • (2003) Drug Discov. Dev. , vol.6 , pp. 30
  • 16
    • 0026099914 scopus 로고
    • R. M. Snider et al., Science 251, 435 (1991).
    • (1991) Science , vol.251 , pp. 435
    • Snider, R.M.1


* 이 정보는 Elsevier사의 SCOPUS DB에서 KISTI가 분석하여 추출한 것입니다.