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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	CHEMBL3747670
Molecular formula	C20H21N11O3
IUPAC name	(1S,2R,3S,4R,5S)-2,3-dihydroxy-N-methyl-4-[6-(methylamino)-2-(4-pyrimidin-2-yltriazol-1-yl)purin-9-yl]bicyclo[3.1.0]hexane-1-carboxamide
Molecular weight	463.462
Hydrogen bond acceptor	11
Hydrogen bond donor	4
XlogP	-1.3
Synonyms	N/A
Inchi Key	ICMWNXPTNGLMIP-SQZQCAMUSA-N
Inchi ID	InChI=1S/C20H21N11O3/c1-21-16-11-17(27-19(26-16)31-7-10(28-29-31)15-23-4-3-5-24-15)30(8-25-11)12-9-6-20(9,18(34)22-2)14(33)13(12)32/h3-5,7-9,12-14,32-33H,6H2,1-2H3,(H,22,34)(H,21,26,27)/t9-,12-,13+,14+,20+/m1/s1
PubChem CID	127039957
ChEMBL	CHEMBL3747670
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has more than 10 hydrogen bond acceptor.

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
525276	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
525277	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
525275	Adenosine receptor A3	Q61618	Adora3	Mus musculus (Mouse)	319

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