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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 H3 receptor
Species	Rattus norvegicus (Rat)
Gene	Hrh3
Synonym	GPCR97 H3 receptor H3R HH3R
Disease	N/A for non-human GPCRs
Length	445
Amino acid sequence	MERAPPDGLMNASGTLAGEAAAAGGARGFSAAWTAVLAALMALLIVATVLGNALVMLAFVADSSLRTQNNFFLLNLAISDFLVGAFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCASSVFNIVLISYDRFLSVTRAVSYRAQQGDTRRAVRKMALVWVLAFLLYGPAILSWEYLSGGSSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGGREAGPEPPPDAQPSPPPAPPSCWGCWPKGHGEAMPLHRYGVGEAGPGVEAGEAALGGGSGGGAAASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSITQRFRLSRDKKVAKSLAIIVSIFGLCWAPYTLLMIIRAACHGRCIPDYWYETSFWLLWANSAVNPVLYPLCHYSFRRAFTKLLCPQKLKVQPHGSLEQCWK
UniProt	Q9QYN8
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	CHEMBL4124
IUPHAR	264
DrugBank	N/A

Ligand

Name	CHEMBL423473
Molecular formula	C15H17IN2O2
IUPAC name	3-(1H-imidazol-5-yl)propyl 3-(4-iodophenyl)propanoate
Molecular weight	384.217
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.1
Synonyms	SCHEMBL8104619 4-Iodobenzenepropionic acid 3-(1H-imidazol-4-yl)propyl ester ZINC13747354 3-(4-Iodo-phenyl)-propionic acid 3-(1H-imidazol-4-yl)-propyl ester BDBM50050168
Inchi Key	ASQUEGTXNJDXRT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H17IN2O2/c16-13-6-3-12(4-7-13)5-8-15(19)20-9-1-2-14-10-17-11-18-14/h3-4,6-7,10-11H,1-2,5,8-9H2,(H,17,18)
PubChem CID	10620015
ChEMBL	CHEMBL423473
IUPHAR	N/A
BindingDB	50050168
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	47.0 nM	PMID8632428	BindingDB,ChEMBL
Ki	50.0 nM	PMID8632428	BindingDB
Ki	50.12 nM	PMID8632428	ChEMBL
Ki	79.43 nM	PMID8632428	BindingDB,ChEMBL

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