Full metadata record

DC Field Value Language
dc.contributor.authorAhmed, Asif-
dc.contributor.authorChoo, Hyunah-
dc.contributor.authorCho, Yong Seo-
dc.contributor.authorPark, Woo-Kyu-
dc.contributor.authorPae, Ae Nim-
dc.date.accessioned2024-01-20T21:03:52Z-
dc.date.available2024-01-20T21:03:52Z-
dc.date.created2021-09-01-
dc.date.issued2009-07-01-
dc.identifier.issn0968-0896-
dc.identifier.urihttps://pubs.kist.re.kr/handle/201004/132327-
dc.description.abstractPharmacophore modelling, docking and virtual screening have become important tool in drug discovery process. Serotonin 2C (5-HT2C) receptor ligands have got major attention for their therapeutic uses as antidepressant and anorectic agents. Two step pharmacophore and docking based virtual screening was done using 5-HT2C agonists. Two common feature pharmacophore directed virtual hits had submicromolar activity. Refined pharmacophore with excluded volumes was constructed and combined with homology model based docking. Best hit from this virtual screening showed IC50 of 20.1 nM. Similarity search of this hit compound resulted more active ligand with 7.8 nM activity. (C) 2009 Elsevier Ltd. All rights reserved.-
dc.languageEnglish-
dc.publisherPERGAMON-ELSEVIER SCIENCE LTD-
dc.subject5-HT RECEPTORS-
dc.subjectPROTEIN-
dc.subjectLOCALIZATION-
dc.subjectPROGRESS-
dc.subjectGENES-
dc.subjectBRAIN-
dc.subjectMICE-
dc.subjectRNA-
dc.subjectCNS-
dc.titleIdentification of novel serotonin 2C receptor ligands by sequential virtual screening-
dc.typeArticle-
dc.identifier.doi10.1016/j.bmc.2009.05.003-
dc.description.journalClass1-
dc.identifier.bibliographicCitationBIOORGANIC & MEDICINAL CHEMISTRY, v.17, no.13, pp.4559 - 4568-
dc.citation.titleBIOORGANIC & MEDICINAL CHEMISTRY-
dc.citation.volume17-
dc.citation.number13-
dc.citation.startPage4559-
dc.citation.endPage4568-
dc.description.journalRegisteredClassscie-
dc.description.journalRegisteredClassscopus-
dc.identifier.wosid000266822900032-
dc.identifier.scopusid2-s2.0-66449114449-
dc.relation.journalWebOfScienceCategoryBiochemistry & Molecular Biology-
dc.relation.journalWebOfScienceCategoryChemistry, Medicinal-
dc.relation.journalWebOfScienceCategoryChemistry, Organic-
dc.relation.journalResearchAreaBiochemistry & Molecular Biology-
dc.relation.journalResearchAreaPharmacology & Pharmacy-
dc.relation.journalResearchAreaChemistry-
dc.type.docTypeArticle-
dc.subject.keywordPlus5-HT RECEPTORS-
dc.subject.keywordPlusPROTEIN-
dc.subject.keywordPlusLOCALIZATION-
dc.subject.keywordPlusPROGRESS-
dc.subject.keywordPlusGENES-
dc.subject.keywordPlusBRAIN-
dc.subject.keywordPlusMICE-
dc.subject.keywordPlusRNA-
dc.subject.keywordPlusCNS-
dc.subject.keywordAuthorSerotonin-
dc.subject.keywordAuthor5-HT-
dc.subject.keywordAuthorAgonist-
dc.subject.keywordAuthorObesity-
dc.subject.keywordAuthorVirtual screening-
Appears in Collections:
KIST Article > 2009
Files in This Item:
There are no files associated with this item.
Export
RIS (EndNote)
XLS (Excel)
XML

qrcode

Items in DSpace are protected by copyright, with all rights reserved, unless otherwise indicated.

BROWSE