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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	Rattus norvegicus (Rat)
Gene	Adora1
Synonym	A1 receptor A1-AR A1R adenosine receptor A1 RDC7
Disease	N/A for non-human GPCRs
Length	326
Amino acid sequence	MPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED
UniProt	P25099
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	CHEMBL318
IUPHAR	18
DrugBank	N/A

Ligand

Name	Xanthine, 1-methyl-3-propyl-
Molecular formula	C9H12N4O2
IUPAC name	1-methyl-3-propyl-7H-purine-2,6-dione
Molecular weight	208.221
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	1.0
Synonyms	D00TQR 1H-Purine-2,6-dione,3,9-dihydro-3-methyl-1-propyl- AKOS030229248 CHEMBL286976 118024-67-2 LS-127052 ZINC4770328 1-Methyl-3-propyl-3,7-dihydro-purine-2,6-dione BDBM50001509 CTK5D5561 1H-Purine-2,6-dione, 3,7-dihydro-1-methyl-3-propyl- SCHEMBL9765669 AC1L3BCB 1-methyl-3-propyl-7H-purine-2,6-dione [ Show all ]
Inchi Key	MCPROACZLSAAPY-UHFFFAOYSA-N
Inchi ID	InChI=1S/C9H12N4O2/c1-3-4-13-7-6(10-5-11-7)8(14)12(2)9(13)15/h5H,3-4H2,1-2H3,(H,10,11)
PubChem CID	86344
ChEMBL	CHEMBL286976
IUPHAR	N/A
BindingDB	50001509
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	6300.0 nM	PMID8230124	BindingDB,ChEMBL

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