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GLASS

You can:

Check the ligand table for details.
Go to the GPCR list to see GPCRs with which this ligand interacts.
Go to the individual GPCR page for PubMed ID information by text mining.
Download a TSV version of all interaction data.
Go back to previous page.

Ligand

Name	CHEMBL27502
Molecular formula	C17H23N5O2
IUPAC name	(1R,2S,4S,5S)-4-[6-(cyclopentylamino)purin-9-yl]-1-(hydroxymethyl)bicyclo[3.1.0]hexan-2-ol
Molecular weight	329.404
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	1.5
Synonyms	BDBM50100422 N-Cyclopentyl-9-[(1beta)-4alpha-hydroxy-5beta-(hydroxymethyl)bicyclo[3.1.0]hexane-2beta-yl]-9H-purine-6-amine (1R,2S,4S,5S)-4-(6-Cyclopentylamino-purin-9-yl)-1-hydroxymethyl-bicyclo[3.1.0]hexan-2-ol
Inchi Key	AKUOJWDGUSDCKF-XREXNNHRSA-N
Inchi ID	InChI=1S/C17H23N5O2/c23-7-17-6-11(17)12(5-13(17)24)22-9-20-14-15(18-8-19-16(14)22)21-10-3-1-2-4-10/h8-13,23-24H,1-7H2,(H,18,19,21)/t11-,12+,13+,17+/m1/s1
PubChem CID	44276002
ChEMBL	CHEMBL27502
IUPHAR	N/A
BindingDB	50100422
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Known GPCRs

You can:

Click GLASS IDs to check the association information.
Click protein names to check details of the GPCRs.
Download a TSV version of all interaction information.

GLASS ID	Name	UniProt	Gene	Species	Length
7909	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
7911	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
7910	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
442027	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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