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GLASS

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GPCR

Name	5-hydroxytryptamine receptor 6
Species	Homo sapiens (Human)
Gene	HTR6
Synonym	5-HT6 receptor 5-hydroxytryptamine (serotonin) receptor 6, G protein-coupled 5-HT-6 serotonin receptor 6 ST-B17 5-HT6 [ Show all ]
Disease	Schizophrenia Obesity Neurological disease Neurodegenerative disease Emesis Cognitive disorders Unspecified Anxiety disorder Alzheimer disease; Dementia Alzheimer disease; Anxiety disorder Alzheimer disease [ Show all ]
Length	440
Amino acid sequence	MVPEPGPTANSTPAWGAGPPSAPGGSGWVAAALCVVIALTAAANSLLIALICTQPALRNTSNFFLVSLFTSDLMVGLVVMPPAMLNALYGRWVLARGLCLLWTAFDVMCCSASILNLCLISLDRYLLILSPLRYKLRMTPLRALALVLGAWSLAALASFLPLLLGWHELGHARPPVPGQCRLLASLPFVLVASGLTFFLPSGAICFTYCRILLAARKQAVQVASLTTGMASQASETLQVPRTPRPGVESADSRRLATKHSRKALKASLTLGILLGMFFVTWLPFFVANIVQAVCDCISPGLFDVLTWLGYCNSTMNPIIYPLFMRDFKRALGRFLPCPRCPRERQASLASPSLRTSHSGPRPGLSLQQVLPLPLPPDSDSDSDAGSGGSSGLRLTAQLLLPGEATQDPPLPTRAAAAVNFFNIDPAEPELRPHPLGIPTN
UniProt	P50406
Protein Data Bank	N/A
GPCR-HGmod model	P50406
3D structure model	This predicted structure model is from GPCR-EXP P50406.
BioLiP	N/A
Therapeutic Target Database	T16691
ChEMBL	CHEMBL3371
IUPHAR	11
DrugBank	BE0000945

Ligand

Name	16502-01-5
Molecular formula	C11H12N2
IUPAC name	2,3,4,9-tetrahydro-1H-pyrido[3,4-b]indole
Molecular weight	172.231
Hydrogen bond acceptor	1
Hydrogen bond donor	2
XlogP	1.5
Synonyms	KB-09915 KS-00000GA0 1,2,3,4-tetrahydro-9H-pyrido(3,4-B)indole NC00329 1,2,3,4-tetrahydropyrido[3,4-b]indole Oprea1_032098 2,3,4,9-tetrahydro-1H-Pyrido[3,4-b]indole SpecPlus_000545 9H-1,2,3,4-Tetrahydropyrido(3,4-b)indole ST24038469 AJ-73372 Tetrahydronorharmane BDBM50130262 CPD000059115 F2113-0962 KBio2_003623 MLS000069483 1,2,3,4-Tetrahydro-9H-pyrido[3,4-b]indole, 98% NCGC00018148-03 1H,2H,3H,4H,9H-Pyrido[3,4-B]Indole SAM001246862 Spectrum4_001858 AB0072711 TC-010568 ALBB-007680 Triptoline CCG-38855 D03LPH HMS2052A05 KBioGR_002297 1,2,3,4-Tetrahydro-9H-pyrido [3,4-b] indole MolPort-000-150-262 1,2,3,4-tetrahydrobeta-carboline Noreleagnine 2,3,4,9-tetrahydro-1H-beta-carboline SMR000059115 65027TMI0H SR-01000000048 AC1Q1H8A Tetrahydro-beta-carboline, 98% BBL027490 ZINC19418965 DS-16389 HMS3394A05 KBio1_001585 MCULE-6905321940 1,2,3,4-tetrahydro-9H-pyrido-[3,4-b]indole NCGC00018148-01 1,2,3,4Tetrahydro-9H-pyrido [3,4-b] indole PubChem16189 2,3,4,9-Tetrahydro-1H-\|A-carboline Spectrum2_001379 9H-Pyrido(3,4-b)indole, 2,3,4,9-tetrahydro- ST50947377 AK-60388 THBC BIDD:GT0403 CS-B1035 FS000806 KBio2_006191 1, 2, 3, 4-tetrahydro-9H-pyrido[3, 4-b]indole MLS001076332 1,2,3,4-Tetrahydro-beta-carboline NCGC00018148-04 1H-Pyrido[3,4-b]indole, 2,3,4,9-tetrahydro- SBB048967 502T015 Spectrum5_000396 AC-17176 tetrahydro beta-carboline ANW-53056 Tryptoline CFTOTSJVQRFXOF-UHFFFAOYSA-N DB-043608 HMS2235E21 InChI=1/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H KBioSS_001055 1,2,3,4-Tetrahydro-9H-pyrido [3,4-b]indole N-8590 1,2,3,4-tetrahydronorharmane Opera_ID_234 2,3,4,9-Tetrahydro-1H-pyrido(3,4-b)indole SPBio_001338 8380AA SR-01000000048-4 ACN-000557 Tetrahydronorharman BC211315 CHEMBL269236 DTXSID10167835 KBio2_001055 MFCD00004954 1,2,3,4-Tetrahydro-9H-pyrido[3,4-b]indole NCGC00018148-02 QC-4504 4CH-021287 Spectrum3_001413 A3668 STK501720 AKOS004119465 TRA0023692 BSPBio_003086 CTK8B6239 FT-0637372 KBio3_002306 1,2,3,4-tetrahydro-1H-pyrido[3,4-b]indole MLS001424178 1,2,3,4-Tetrahydro-\|A-carboline NCGC00023426-03 2,3,4,9-Tetrahydro-1H-beta-carbolin SCHEMBL171755 58911-02-7 (mono-hydrochloride) Spectrum_000575 AC1L32U9 Tetrahydro-beta-carboline BB 0260537 UNII-65027TMI0H CHEBI:92568 DivK1c_006641 HMS3370D07 [ Show all ]
Inchi Key	CFTOTSJVQRFXOF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H12N2/c1-2-4-10-8(3-1)9-5-6-12-7-11(9)13-10/h1-4,12-13H,5-7H2
PubChem CID	107838
ChEMBL	CHEMBL269236
IUPHAR	N/A
BindingDB	50130262
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
Ki	<5000.0 nM	PMID12825922	BindingDB,ChEMBL

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