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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.
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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	6-(4-methylpiperazin-1-yl)-9H-purine
Molecular formula	C10H14N6
IUPAC name	6-(4-methylpiperazin-1-yl)-7H-purine
Molecular weight	218.264
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	0.5
Synonyms	6-(4-methylpiperazinyl)purine MolPort-000-384-358 SR-01000104630 AC1LFNRL F0578-0118 NSC510935 STK630143 BDBM50304512 MCULE-5386395090 SDCCGMLS-0065440.P001 99172-01-7 CHEMBL594152 MolPort-000-847-583 SR-01000104630-1 AKOS001427557 HMS1650E09 Oprea1_666011 Z57745256 6-(4-methylpiperazin-1-yl)-9Hpurine CCG-26902 MLS000419169 SMR000319851 AB00588487-02 D0QT2F NSC-510935 ST45178781 6-(4-methylpiperazin-1-yl)-7H-purine AKOS005562847 HMS2684L19 SCHEMBL13718480 ZINC213869 [ Show all ]
Inchi Key	AXPCNBLIEMWMMG-UHFFFAOYSA-N
Inchi ID	InChI=1S/C10H14N6/c1-15-2-4-16(5-3-15)10-8-9(12-6-11-8)13-7-14-10/h6-7H,2-5H2,1H3,(H,11,12,13,14)
PubChem CID	756701
ChEMBL	CHEMBL594152
IUPHAR	N/A
BindingDB	50304512
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	18400.0 nM	PMID19773175	BindingDB,ChEMBL

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