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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	CHEMBL2113418
Molecular formula	C13H18N6O4
IUPAC name	(2S,3R,4R,5R)-5-(6-aminopurin-9-yl)-N-ethyl-3,4-dihydroxy-4-methyloxolane-2-carboxamide
Molecular weight	322.325
Hydrogen bond acceptor	8
Hydrogen bond donor	4
XlogP	-1.4
Synonyms	BDBM50408412 2'-Methyl-5'-(ethylamino)-5'-oxo-5'-deoxyadenosine
Inchi Key	FAGCJFVAXVJDMA-XDPNNTCOSA-N
Inchi ID	InChI=1S/C13H18N6O4/c1-3-15-11(21)7-8(20)13(2,22)12(23-7)19-5-18-6-9(14)16-4-17-10(6)19/h4-5,7-8,12,20,22H,3H2,1-2H3,(H,15,21)(H2,14,16,17)/t7-,8+,12+,13+/m0/s1
PubChem CID	10567830
ChEMBL	CHEMBL2113418
IUPHAR	N/A
BindingDB	50408412
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
73364	Adenosine receptor A1	P28190	ADORA1	Bos taurus (Bovine)	326
73365	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
73363	Adenosine receptor A3	P28647	Adora3	Rattus norvegicus (Rat)	320
444609	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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