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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	CHEMBL382194
Molecular formula	C18H20IN7O4
IUPAC name	[(2S,3S,4R,5R)-4-hydroxy-2-(hydroxymethyl)-5-[6-[(3-iodophenyl)methylamino]purin-9-yl]oxolan-3-yl]urea
Molecular weight	525.307
Hydrogen bond acceptor	8
Hydrogen bond donor	5
XlogP	0.4
Synonyms	MRS-3481 N6-(3-iodobenzyl)-9-(3-deoxy-3-ureido-B-D-ribofuranosyl)adenine BDBM50185932
Inchi Key	ABGDLYABGFCQLB-CTWCOEIASA-N
Inchi ID	InChI=1S/C18H20IN7O4/c19-10-3-1-2-9(4-10)5-21-15-13-16(23-7-22-15)26(8-24-13)17-14(28)12(25-18(20)29)11(6-27)30-17/h1-4,7-8,11-12,14,17,27-28H,5-6H2,(H3,20,25,29)(H,21,22,23)/t11-,12-,14-,17-/m1/s1
PubChem CID	11584486
ChEMBL	CHEMBL382194
IUPHAR	N/A
BindingDB	50185932
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

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
829	Adenosine receptor A1	P30542	ADORA1	Homo sapiens (Human)	326
828	Adenosine receptor A2a	P29274	ADORA2A	Homo sapiens (Human)	412
441703	Adenosine receptor A3	P0DMS8	ADORA3	Homo sapiens (Human)	318

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