title: Discovery of 5-HT6 receptor ligands based on virtual HTS.
abstract: Based on a pharmacophore alignment on a 5-HT(6) ligand applying 4SCan technology, a new lead series was identified and further structurally investigated. K(i)s down to 8 nM were achieved.
authors: 4SC AG, Am Klopferspitz 19a, 82152 Planegg-Martinsried, Germany. stefan.tasler@4sc.com
authors: Stefan
authors: S
authors: Tasler
authors: Jürgen
authors: J
authors: Kraus
authors: Andreas
authors: A
authors: Wuzik
authors: Oliver
authors: O
authors: Müller
authors: Andrea
authors: A
authors: Aschenbrenner
authors: Elena
authors: E
authors: Cubero
authors: Rosalia
authors: R
authors: Pascual
authors: Jordi-Ramon
authors: JR
authors: Quintana-Ruiz
authors: Alberto
authors: A
authors: Dordal
authors: Ramon
authors: R
authors: Mercè
authors: Xavier
authors: X
authors: Codony
mesh_terms: D000814:Aniline Compounds / Q000737:chemistry* / Q000494:pharmacology; D003198:Computer Simulation; D015195:Drug Design; D006801:Humans; D007211:Indoles / Q000737:chemistry / Q000494:pharmacology; D008024:Ligands; D008958:Models, Molecular; D015394:Molecular Structure; D000077489:Piperazine; D010879:Piperazines / Q000737:chemistry* / Q000494:pharmacology; D011985:Receptors, Serotonin / Q000737:chemistry* / Q000187:drug effects / Q000378:metabolism; D012984:Software; D013329:Structure-Activity Relationship; D013449:Sulfonamides / Q000737:chemistry* / Q000494:pharmacology
chemical_list: D000814:Aniline Compounds; D007211:Indoles; D008024:Ligands; C500059:N-(3-(2-dimethylaminoethyl)-1H-indol-5-yl)-5-chloronaphthalene-2-sulfonamide; D010879:Piperazines; D011985:Receptors, Serotonin; D013449:Sulfonamides; C097216:serotonin 6 receptor; D000077489:Piperazine; C023650:aniline