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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 H4 receptor
Species	Homo sapiens (Human)
Gene	HRH4
Synonym	Pfi-013 SP9144 HH4R H4R H4 receptor GPRv53 GPCR105 G-protein coupled receptor 105 AXOR35 [ Show all ]
Disease	Allergic rhinitis Asthma Inflammatory disease Rheumatoid arthritis
Length	390
Amino acid sequence	MPDTNSTINLSLSTRVTLAFFMSLVAFAIMLGNALVILAFVVDKNLRHRSSYFFLNLAISDFFVGVISIPLYIPHTLFEWDFGKEICVFWLTTDYLLCTASVYNIVLISYDRYLSVSNAVSYRTQHTGVLKIVTLMVAVWVLAFLVNGPMILVSESWKDEGSECEPGFFSEWYILAITSFLEFVIPVILVAYFNMNIYWSLWKRDHLSRCQSHPGLTAVSSNICGHSFRGRLSSRRSLSASTEVPASFHSERQRRKSSLMFSSRTKMNSNTIASKMGSFSQSDSVALHQREHVELLRARRLAKSLAILLGVFAVCWAPYSLFTIVLSFYSSATGPKSVWYRIAFWLQWFNSFVNPLLYPLCHKRFQKAFLKIFCIKKQPLPSQHSRSVSS
UniProt	Q9H3N8
Protein Data Bank	N/A
GPCR-HGmod model	Q9H3N8
3D structure model	This predicted structure model is from GPCR-EXP Q9H3N8.
BioLiP	N/A
Therapeutic Target Database	T26500
ChEMBL	CHEMBL3759
IUPHAR	265
DrugBank	BE0000146

Ligand

Name	CHEMBL306077
Molecular formula	C11H20N4S
IUPAC name	1-[4-(1H-imidazol-5-yl)butyl]-3-propan-2-ylthiourea
Molecular weight	240.369
Hydrogen bond acceptor	2
Hydrogen bond donor	3
XlogP	1.2
Synonyms	N-[4-(1H-Imidazol-4-yl)butyl]-N'-isopropylthiourea 1-[4-(1H-imidazol-4-yl)butyl]-3-propan-2-ylthiourea VUF 4683 BDBM22896
Inchi Key	BAFIAMAZLRISIH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C11H20N4S/c1-9(2)15-11(16)13-6-4-3-5-10-7-12-8-14-10/h7-9H,3-6H2,1-2H3,(H,12,14)(H2,13,15,16)
PubChem CID	10060213
ChEMBL	CHEMBL306077
IUPHAR	N/A
BindingDB	22896
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	19.95 nM	PMID21044842	ChEMBL
Intrinsic activity	0.8 -	PMID21044842	ChEMBL
Ki	7.943 nM	PMID21044842	ChEMBL
Ki	8.0 nM	PMID15947036	BindingDB

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