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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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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	CHEMBL327853
Molecular formula	C13H7ClN4O2
IUPAC name	8-chloro-2-(furan-3-yl)-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one
Molecular weight	286.675
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	2.3
Synonyms	2-(3-Furyl)-8-chloro[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one 8-Chloro-2-furan-3-yl-5H-[1,2,4]triazolo[1,5-a]quinoxalin-4-one BDBM50039956 8-chloro-2-(furan-3-yl)-[1,2,4]triazolo[1,5-a]quinoxalin-4(5H)-one
Inchi Key	CUIKPBVRWVBNLW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C13H7ClN4O2/c14-8-1-2-9-10(5-8)18-12(13(19)15-9)16-11(17-18)7-3-4-20-6-7/h1-6H,(H,15,19)
PubChem CID	10062568
ChEMBL	CHEMBL327853
IUPHAR	N/A
BindingDB	50039956
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	1950.0 nM	PMID16335918	BindingDB,ChEMBL

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