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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Histamine H1 receptor
Species	Mus musculus (Mouse)
Gene	Hrh1
Synonym	H1 receptor H1R HH1R Hisr
Disease	N/A for non-human GPCRs
Length	488
Amino acid sequence	MSLPNTSSASEDKMCEGNRTAMASPQLLPLVVVLSSISLVTVGLNLLVLYAVRSERKLHTVGNLYIVSLSVADLIVGAVVMPMNILYLIMTKWSLGRPLCLFWLSMDYVASTASIFSVFILCIDRYRSVQQPLRYLRYRTKTRASATILGAWFLSFLWVIPILGWHHFTPLAPELREDKCETDFYNVTWFKIMTAIINFYLPTLLMLWFYVKIYKAVRRHCQHRQLTNGSLPTFLEIKLRSEDAKEGAKKPGKESPWGVQKRPSRDPTGGLDQKSTSEDPKVTSPTVFSQEGERETVTRPCFRLDVMQTQPVPEGDARGSKANDQTLSQPKMDEQSLSTCRRISETSEDQTLVDRQSFSRTTDSDTSIEPGLGKVKARSRSNSGLDYIKVTWKRLRSHSRQYVSGLHLNRERKAAKQLGCIMAAFILCWIPYFIFFMVIAFCNSCCSEPVHMFTIWLGYINSTLNPLIYPLCNENFKKTFKKILHIRS
UniProt	P70174
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	CHEMBL4322
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL146253
Molecular formula	C22H23FN2O3
IUPAC name	3-[4-(8-fluoro-5H-[1]benzoxepino[4,3-b]pyridin-11-ylidene)piperidin-1-yl]-2-methylpropanoic acid
Molecular weight	382.435
Hydrogen bond acceptor	6
Hydrogen bond donor	1
XlogP	0.2
Synonyms	4-[8-Fluoro[1]benzoxepino[4,3-b]pyridin-11(5H)-ylidene]-alpha-methylpiperidine-1-propanoic acid
Inchi Key	GYFNWATWLSITGL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H23FN2O3/c1-14(22(26)27)12-25-9-6-15(7-10-25)20-18-5-4-17(23)11-19(18)28-13-16-3-2-8-24-21(16)20/h2-5,8,11,14H,6-7,9-10,12-13H2,1H3,(H,26,27)
PubChem CID	10068466
ChEMBL	CHEMBL146253
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
ID50	2.3 mg.kg-1	PMID7853343	ChEMBL

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