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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	CHEMBL606438
Molecular formula	C12H13N5O4
IUPAC name	(3R,4S,5R)-2-(6-aminopurin-9-yl)-5-[(1S)-1-hydroxyprop-2-ynyl]oxolane-3,4-diol
Molecular weight	291.267
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	-0.9
Synonyms	BDBM50369378
Inchi Key	HDHDZFOKOBYFND-QHHQSULJSA-N
Inchi ID	InChI=1S/C12H13N5O4/c1-2-5(18)9-7(19)8(20)12(21-9)17-4-16-6-10(13)14-3-15-11(6)17/h1,3-5,7-9,12,18-20H,(H2,13,14,15)/t5-,7-,8+,9+,12?/m0/s1
PubChem CID	46875034
ChEMBL	CHEMBL606438
IUPHAR	N/A
BindingDB	50369378
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
112001	Adenosine receptor A1	P25099	Adora1	Rattus norvegicus (Rat)	326
112000	Adenosine receptor A2a	P30543	Adora2a	Rattus norvegicus (Rat)	410
111999	Adenosine receptor A2b	P29276	Adora2b	Rattus norvegicus (Rat)	332

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