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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	Bos taurus (Bovine)
Gene	ADORA1
Synonym	N/A
Disease	N/A for non-human GPCRs
Length	326
Amino acid sequence	MPPSISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPRTYFHTCLKVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTPRRAVVAITGCWILSFVVGLTPMFGWNNLSAVERDWLANGSVGEPVIECQFEKVISMEYMVYFNFFVWVLPPLLLMVLIYMEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPSCHMPRILIYIAIFLSHGNSAMNPIVYAFRIQKFRVTFLKIWNDHFRCQPAPPVDEDAPAERPDD
UniProt	P28190
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	CHEMBL4975
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL324100
Molecular formula	C19H12N4O2
IUPAC name	3-(furan-2-yl)-10-phenyl-[1,2,4]triazino[4,3-a]benzimidazol-4-one
Molecular weight	328.331
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	3.3
Synonyms	3-(2-Furyl)-10-phenyl[1,2,4]triazino[4,3-a]benzimidazole-4(10H)-one BDBM50102287 3-Furan-2-yl-10-phenyl-10H-benzo[4,5]imidazo[2,1-c][1,2,4]triazin-4-one
Inchi Key	AWLXMIOPONXPFQ-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H12N4O2/c24-18-17(16-11-6-12-25-16)20-21-19-22(13-7-2-1-3-8-13)14-9-4-5-10-15(14)23(18)19/h1-12H
PubChem CID	10687707
ChEMBL	CHEMBL324100
IUPHAR	N/A
BindingDB	50102287
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	315.0 nM	PMID11462973	BindingDB,ChEMBL

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