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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.
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 A3
Species	Rattus norvegicus (Rat)
Gene	Adora3
Synonym	A3 receptor A3AR Adenosine receptor A3 ARA3 TGPCR1
Disease	N/A for non-human GPCRs
Length	320
Amino acid sequence	MKANNTTTSALWLQITYITMEAAIGLCAVVGNMLVIWVVKLNRTLRTTTFYFIVSLALADIAVGVLVIPLAIAVSLEVQMHFYACLFMSCVLLVFTHASIMSLLAIAVDRYLRVKLTVRYRTVTTQRRIWLFLGLCWLVSFLVGLTPMFGWNRKVTLELSQNSSTLSCHFRSVVGLDYMVFFSFITWILIPLVVMCIIYLDIFYIIRNKLSQNLTGFRETRAFYGREFKTAKSLFLVLFLFALCWLPLSIINFVSYFNVKIPEIAMCLGILLSHANSMMNPIVYACKIKKFKETYFVILRACRLCQTSDSLDSNLEQTTE
UniProt	P28647
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	CHEMBL3360
IUPHAR	21
DrugBank	N/A

Ligand

Name	CHEMBL327016
Molecular formula	C17H24N4O4
IUPAC name	(E)-3-(1,3-dibutyl-7-methyl-2,6-dioxopurin-8-yl)prop-2-enoic acid
Molecular weight	348.403
Hydrogen bond acceptor	5
Hydrogen bond donor	1
XlogP	2.1
Synonyms	(E)-3-(1,3-Dibutyl-7-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin-8-yl)-acrylic acid BDBM50037442 (E)-3-[(1,3-Dibutyl-7-methyl-2,6-dioxo-2,3,6,7-tetrahydro-1H-purin)-8-yl]propenoic acid
Inchi Key	FIKYVDWEEHJVOL-CMDGGOBGSA-N
Inchi ID	InChI=1S/C17H24N4O4/c1-4-6-10-20-15-14(16(24)21(17(20)25)11-7-5-2)19(3)12(18-15)8-9-13(22)23/h8-9H,4-7,10-11H2,1-3H3,(H,22,23)/b9-8+
PubChem CID	10472934
ChEMBL	CHEMBL327016
IUPHAR	N/A
BindingDB	50037442
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	127000.0 nM	PMID7932565	BindingDB,ChEMBL

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