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GLASS

You can:

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	Cavia porcellus (Guinea pig)
Gene	HRH3
Synonym	H3R HH3R
Disease	N/A for non-human GPCRs
Length	445
Amino acid sequence	MERAPPDGLMNASGALAGEAAAAAGGARTFSAAWTAVLAALMALLIVATVLGNALVMLAFVADSSLRTQNNFFLLNLAISDFLVGVFCIPLYVPYVLTGRWTFGRGLCKLWLVVDYLLCTSSVFNIVLISYDRFLSVTRAVSYRAQQGDTRRAVRKMVLVWVLAFLLYGPAILSWEYLSGGSSIPEGHCYAEFFYNWYFLITASTLEFFTPFLSVTFFNLSIYLNIQRRTRLRLDGGAREAGPDPLPEAQSSPPQPPPGCWGCWPKGQGESMPLHRYGVGEAGPGAEAGEAALGGGSGAAASPTSSSGSSSRGTERPRSLKRGSKPSASSASLEKRMKMVSQSITQRFRLSRDKKVAKSLAIIVSIFGLCWAPYTLLMIIRAACHGHCVPDYWYETSFWLLWANSAVNPVLYPLCHYSFRRAFTKLLCPQKLKVQPHSSLEHCWK
UniProt	Q9JI35
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	CHEMBL5076
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL68764
Molecular formula	C17H25N3O2S
IUPAC name	4-tert-butyl-N-[4-(1H-imidazol-5-yl)butyl]benzenesulfonamide
Molecular weight	335.466
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	3.4
Synonyms	BDBM50071356 SCHEMBL8314642 4-tert-Butyl-N-[4-(1H-imidazol-4-yl)-butyl]-benzenesulfonamide
Inchi Key	AQPCMVKDEWVILC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C17H25N3O2S/c1-17(2,3)14-7-9-16(10-8-14)23(21,22)20-11-5-4-6-15-12-18-13-19-15/h7-10,12-13,20H,4-6,11H2,1-3H3,(H,18,19)
PubChem CID	10359599
ChEMBL	CHEMBL68764
IUPHAR	N/A
BindingDB	50071356
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
ED50	3.0 mg.kg-1	PMID9873505	ChEMBL
Kd	15.85 nM	PMID9873505	ChEMBL
Ki	16.5 nM	PMID9873505	ChEMBL
Ki	17.0 nM	PMID9873505	BindingDB

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