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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	CHEMBL2089335
Molecular formula	C20H19N5O2
IUPAC name	(1R,2R,3S,4R,5S)-4-[6-(methylamino)-2-(2-phenylethynyl)purin-9-yl]bicyclo[3.1.0]hexane-2,3-diol
Molecular weight	361.405
Hydrogen bond acceptor	6
Hydrogen bond donor	3
XlogP	1.6
Synonyms	BDBM50420417
Inchi Key	OYNJUFHNXILXDR-NFIDOXACSA-N
Inchi ID	InChI=1S/C20H19N5O2/c1-21-19-15-20(24-14(23-19)8-7-11-5-3-2-4-6-11)25(10-22-15)16-12-9-13(12)17(26)18(16)27/h2-6,10,12-13,16-18,26-27H,9H2,1H3,(H,21,23,24)/t12-,13+,16+,17+,18-/m0/s1
PubChem CID	70689193
ChEMBL	CHEMBL2089335
IUPHAR	N/A
BindingDB	50420417
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
253416	Adenosine receptor A1	Q60612	Adora1	Mus musculus (Mouse)	326
253419	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
253415	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
253417	Adenosine receptor A2a	Q60613	Adora2a	Mus musculus (Mouse)	410
253418	Adenosine receptor A3	Q61618	Adora3	Mus musculus (Mouse)	319
451687	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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