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| Type |
Poster Presentation |
| Area |
의약화학 |
| Room No. |
포스터발표장 |
| Time |
4월 20일 (목요일) 11:00~12:30 |
| Code |
MEDI.P-431 |
| Subject |
PreMetabo: Software for drug metabolism prediction |
| Authors |
황성보, 신성은1, 서명원, 신현길, 노경태*
연세대학교 생명공학과, Korea
1(사)분자설계연구소 화학생물정보연구팀, Korea
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| Abstract |
Drug metabolism in hepatocytes attracted many researchers’ interests since metabolism reactions alter toxicity and efficacy of drug molecules. Researches on metabolism revealed the proteins playing major role in drug metabolism; cytochrome P450 enzymes (CYPs) for phase I reaction, UDP-glucuronosyltransferases (UGTs) and sulfotransferases (SULTs) for phase II reaction, and P-glycoprotein (P-gp) for transportation of drug molecule.
“PreMetabo” is user-friendly software to predict metabolism of drug molecules for helping users to make decision in early stage. It is named by combining the words ‘prediction’ and ‘metabolism.’ Metabolism predictions are useful to understand fate of drug molecules in hepatocytes. The software is composed of modules to predict site of metabolism by CYPs, and to classify substrate of CYP2D6, CYP3A4, UGT, SULT, and P-gp, or inhibitor of CYP2C9, CYP2C19, CYP2D6, and CYP3A4. PreMetabo is not only implemented as GUI version, but also as web version to make it accessible to everyone.
(https://premetabo.bmdrc.kr/) |
| E-mail |
tyamazaki@naver.com |
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119th General Meeting of the KCS