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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	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	CHEMBL72117
Molecular formula	C15H18N4O2
IUPAC name	5,7-dipropyl-1H-imidazo[4,5-g]quinazoline-6,8-dione
Molecular weight	286.335
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	2.2
Synonyms	BDBM50018580 5,7-Dipropyl-1,5-dihydro-imidazo[4,5-g]quinazoline-6,8-dione
Inchi Key	ABGATFKESODHNX-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H18N4O2/c1-3-5-18-13-8-12-11(16-9-17-12)7-10(13)14(20)19(6-4-2)15(18)21/h7-9H,3-6H2,1-2H3,(H,16,17)
PubChem CID	44311876
ChEMBL	CHEMBL72117
IUPHAR	N/A
BindingDB	50018580
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	123.0 nM	PMID2795597	BindingDB,ChEMBL

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