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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 H4 receptor
Species	Rattus norvegicus (Rat)
Gene	Hrh4
Synonym	GPCR105 H4 receptor H4R HH4R
Disease	N/A for non-human GPCRs
Length	391
Amino acid sequence	MSESNGTDVLPLTAQVPLAFLMSLLAFAITIGNAVVILAFVADRNLRHRSNYFFLNLAISDFFVGVISIPLYIPHTLFNWNFGSGICMFWLITDYLLCTASVYSIVLISYDRYQSVSNAVRYRAQHTGILKIVAQMVAVWILAFLVNGPMILASDSWKNSTNTEECEPGFVTEWYILAITAFLEFLLPVSLVVYFSVQIYWSLWKRGSLSRCPSHAGFIATSSRGTGHSRRTGLACRTSLPGLKEPAASLHSESPRGKSSLLVSLRTHMSGSIIAFKVGSFCRSESPVLHQREHVELLRGRKLARSLAVLLSAFAICWAPYCLFTIVLSTYRRGERPKSIWYSIAFWLQWFNSLINPFLYPLCHRRFQKAFWKILCVTKQPAPSQTQSVSS
UniProt	Q91ZY1
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	CHEMBL4468
IUPHAR	265
DrugBank	N/A

Ligand

Name	CHEMBL503605
Molecular formula	C13H14ClN3O
IUPAC name	(5-chloro-1H-indol-2-yl)-piperazin-1-ylmethanone
Molecular weight	263.725
Hydrogen bond acceptor	2
Hydrogen bond donor	2
XlogP	1.8
Synonyms	(5-chloro-1H-indol-2-yl)(piperazino)methanone RNGVSSIIHLHHSN-UHFFFAOYSA-N BB 0247847 (5-Chloro-1H-indol-2-yl)-piperazin-1-yl-metha none 5-chloro-2-(piperazin-1-ylcarbonyl)-1H-indole SCHEMBL6130879 BDBM26391 (5-Chloro-1H-indol-2-yl)-piperazin-1-yl-methanone JNJ 7777120 analogue, 4 AKOS016342960 ZINC32500347 [ Show all ]
Inchi Key	RNGVSSIIHLHHSN-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H14ClN3O/c14-10-1-2-11-9(7-10)8-12(16-11)13(18)17-5-3-15-4-6-17/h1-2,7-8,15-16H,3-6H2
PubChem CID	21638785
ChEMBL	CHEMBL503605
IUPHAR	N/A
BindingDB	26391
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
EC50	30.9 nM	PMID18817367	ChEMBL
Ki	3.981 nM	PMID18817367	ChEMBL
Ki	4.0 nM	PMID18817367	BindingDB

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