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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	CHEMBL3659226
Molecular formula	C21H22N6O2
IUPAC name	[6-methyl-3-(triazol-2-yl)pyridin-2-yl]-[2-(pyridin-3-yloxymethyl)-7-azabicyclo[2.2.1]heptan-7-yl]methanone
Molecular weight	390.447
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	2.6
Synonyms	US9062078, 58 BDBM163927 SCHEMBL16041506
Inchi Key	BFKVCDQIAXRADW-UHFFFAOYSA-N
Inchi ID	InChI=1S/C21H22N6O2/c1-14-4-6-19(27-23-9-10-24-27)20(25-14)21(28)26-16-5-7-18(26)15(11-16)13-29-17-3-2-8-22-12-17/h2-4,6,8-10,12,15-16,18H,5,7,11,13H2,1H3
PubChem CID	90412885
ChEMBL	CHEMBL3659226
IUPHAR	N/A
BindingDB	163927
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
465663	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
517444	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
465664	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444

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