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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	Adenosine receptor A1
Species	Cavia porcellus (Guinea pig)
Gene	ADORA1
Synonym	N/A
Disease	N/A for non-human GPCRs
Length	326
Amino acid sequence	MPHSVSAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIASLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAAVAIAGCWILSLVVGLTPMFGWNNLSKIEMAWAANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLSKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCHKPTILTYIAIFLTHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPEPPIDEDLPEEKVDD
UniProt	P47745
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	CHEMBL2304404
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL28684
Molecular formula	C12H17N5O3
IUPAC name	3-(1-methyl-2,6-dioxo-3-propylpurin-7-yl)propanamide
Molecular weight	279.3
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	-0.8
Synonyms	3-(1-Methyl-2,6-dioxo-3-propyl-1,2,3,6-tetrahydro-purin-7-yl)-propionamide BDBM50047251 3-[(1-Methyl-3-propyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin)-7-yl]propanamide
Inchi Key	GCVNXDOEXKIURX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C12H17N5O3/c1-3-5-17-10-9(11(19)15(2)12(17)20)16(7-14-10)6-4-8(13)18/h7H,3-6H2,1-2H3,(H2,13,18)
PubChem CID	10107643
ChEMBL	CHEMBL28684
IUPHAR	N/A
BindingDB	50047251
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	<200000.0 nM	PMID8496906	BindingDB,ChEMBL

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