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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 A2a
Species	Cavia porcellus (Guinea pig)
Gene	ADORA2A
Synonym	N/A
Disease	N/A for non-human GPCRs
Length	409
Amino acid sequence	MSSSVYITVELVIAVLAILGNVLVCWAVWINSNLQNVTNYFVVSLAAADIAVGVLAIPFAITISTGFCAACHGCLFFACFVLVLTQSSIFSLLTITIDRYIAIRIPLRYNGLVTCTRAKGIIAICWVLSFAIGLTPMLGWNNCSQPKGDKNHSESCDEGQVTCLFEDVVPMNYMVYYNFFAFVLVPLLLMLGIYLRIFLAARRQLKQMESQPLPGERTRSTLQKEVHPAKSLAIIVGLFALCCLPLNIINCFTFFCPECDHAPPWLMYLTIILSHGNSVVNPLIYAYRIREFRQTFRKIIRSHILRRRELFKAGGTSARASAAHSPEGEQVSLRLNGHPPGVWANGSALRPEQRPNGYVLGLVSGRSAQRSHGDASLSDVELLSHEHKGTCPESPSLEDPPAHGGAGVS
UniProt	P46616
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	CHEMBL2605
IUPHAR	N/A
DrugBank	N/A

Ligand

Name	CHEMBL25303
Molecular formula	C8H10N4O3
IUPAC name	1-(2-hydroxyethyl)-3-methyl-7H-purine-2,6-dione
Molecular weight	210.193
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	-0.7
Synonyms	BDBM50025572 SXRDFSLBAAYEPE-UHFFFAOYSA-N 1-(2-Hydroxy-ethyl)-3-methyl-3,7-dihydro-purine-2,6-dione AC1O4ZVL 1-(2-hydroxyethyl)-3-methyl-7H-purine-2,6-dione
Inchi Key	SXRDFSLBAAYEPE-UHFFFAOYSA-N
Inchi ID	InChI=1S/C8H10N4O3/c1-11-6-5(9-4-10-6)7(14)12(2-3-13)8(11)15/h4,13H,2-3H2,1H3,(H,9,10)
PubChem CID	6424576
ChEMBL	CHEMBL25303
IUPHAR	N/A
BindingDB	50025572
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	50000.0 nM	PMID3806581	BindingDB,ChEMBL

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