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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Histamine H1 receptor
Species	Rattus norvegicus (Rat)
Gene	Hrh1
Synonym	H1 receptor H1R HH1R Hisr
Disease	N/A for non-human GPCRs
Length	486
Amino acid sequence	MSFANTSSTFEDKMCEGNRTAMASPQLLPLVVVLSSISLVTVGLNLLVLYAVHSERKLHTVGNLYIVSLSVADLIVGAVVMPMNILYLIMTKWSLGRPLCLFWLSMDYVASTASIFSVFILCIDRYRSVQQPLRYLRYRTKTRASATILGAWFFSFLWVIPILGWHHFMPPAPELREDKCETDFYNVTWFKIMTAIINFYLPTLLMLWFYVKIYKAVRRHCQHRQLTNGSLPSFSELKLRSDDTKEGAKKPGRESPWGVLKRPSRDPSVGLDQKSTSEDPKMTSPTVFSQEGERETRPCFRLDIMQKQSVAEGDVRGSKANDQALSQPKMDEQSLNTCRRISETSEDQTLVDQQSFSRTTDSDTSIEPGPGRVKSRSGSNSGLDYIKITWKRLRSHSRQYVSGLHLNRERKAAKQLGFIMAAFILCWIPYFIFFMVIAFCKSCCSEPMHMFTIWLGYINSTLNPLIYPLCNENFKKTFKKILHIRS
UniProt	P31390
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL4701
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	protriptyline
Molecular formula	C19H21N
IUPAC name	N-methyl-3-(2-tricyclo[9.4.0.03,8]pentadeca-1(15),3,5,7,9,11,13-heptaenyl)propan-1-amine
Molecular weight	263.384
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	4.4
Synonyms	NCGC00015851-07 PDSP2_001374 3-(5H-dibenzo[a,d][7]annulen-5-yl)-N-methylpropan-1-amine 5H-Dibenzo[a, d]cycloheptene-5-propanamine, N-methyl-, hydrochloride SBI-0050947.P002 ACM438608 Vivactil BPBio1_000924 CHEBI:8597 DTXSID0023535 LS-60771 N-Methyl-5H-dibenzo[a,d]cycloheptene-5-propanamine NCGC00015851-02 Novo-Doxepin 1225-55-4 (HYDROCHLORIDE) Prestwick2_000930 5-(3-Methylaminopropyl)-5H-dibenzo(a,d)cycloheptene Protriptylinum 7-(3-Methylaminopropyl)-1,2:5,6-dibenzocycloheptatriene Triadapin 5 AN-5942 Vivactyl BSPBio_000840 Concordin HSDB 3391 methyl(3-{tricyclo[9.4.0.0;{3,8}]pentadeca-1(11),3(8),4,6,9,12,14-heptaen-2-yl}propyl)amine NCGC00015851-05 NSC169912 3-(5H-Dibenzo[a,d]cyclohepten-5-yl)-N-methyl-1-propanamine Protriptilina [INN-Spanish] 5H-Dibenzo(a,d)cycloheptene-5-propanamine, N-methyl- PROTRYPTYLINE HYDROCHLORIDE AC-15971 Triptyl BDBM50176062 CAS-1225-55-4 D08447 Lopac-P-8813 N-3-(5H-Dibenzo(a,d)cyclohepten-5-yl)propyl-N-methylamine NCGC00024439-03 Prestwick0_000930 438-60-8 Protriptyline (INN) 5H-Dibenzo[a,d]cycloheptene-5-propanamine, N-methyl- SCHEMBL34267 AKOS015962184 Vivactil (Salt/Mix) BRD-K42098891-003-03-1 EINECS 207-119-9 Maximed N-Methyl-5H-dibenzo[a,d]cycloheptene-5-propylamine NCGC00015851-03 Novo-Tripramine 3-(11H-dibenzo[1,2-a:1',2'-e][7]annulen-11-yl)-N-methylpropan-1-amine Prestwick3_000930 5-(3-Methylaminopropyl)-5H-Dibenzo[a,d]cycloheptene Protriptylinum [INN-Latin] AB00489964 Triptil Apo-Imipramine ZINC1530764 BWPIARFWQZKAIA-UHFFFAOYSA-N Concordin (Salt/Mix) Impril MK 240 NCGC00015851-06 PDSP1_001390 3-(5H-Dibenzo[a,d]cyclohepten-5-yl)-N-methyl-1-propanamine # Protriptylin 5H-Dibenzo(a,d)cycloheptene-5-propylamine, N-methyl- Rhotrimine AC1L1JCC UNII-4NDU154T12 BIDD:PXR0157 CCG-205054 DB00344 Lopac0_000974 N-Methyl-5H-dibenzo(a,d)cycloheptene-5-propylamine NCGC00015851-01 Normethyl EX4442 Prestwick1_000930 4NDU154T12 Protriptyline [INN:BAN] 5H-Dibenzo[a,d]cycloheptene-5-propylamine, N-methyl- SPBio_003019 Amimetilina Vivactil (TN) BRN 2217411 CHEMBL668 GTPL7285 MCULE-6023848462 NCGC00015851-04 Novopramine 3-(11H-dibenzo[[?],[?]][7]annulen-11-yl)-N-methyl-propan-1-amine Protriptilina Protryptyline AB00489964_10 Triptil hydrochloride Apo-Trimip C07408 D00MYQ L000913 MK-240 [ Show all ]
Inchi Key	BWPIARFWQZKAIA-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H21N/c1-20-14-6-11-19-17-9-4-2-7-15(17)12-13-16-8-3-5-10-18(16)19/h2-5,7-10,12-13,19-20H,6,11,14H2,1H3
PubChem CID	4976
ChEMBL	CHEMBL668
IUPHAR	N/A
BindingDB	50176062
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	60.0 nM	PMID282646	BindingDB

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