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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	Orexin receptor antagonist 8
Molecular formula	C21H19FN6O2
IUPAC name	2-[(3R,6R)-1-[4-fluoro-2-(triazol-2-yl)benzoyl]-6-methylpiperidin-3-yl]oxypyridine-4-carbonitrile
Molecular weight	406.421
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	3.1
Synonyms	SCHEMBL14876844 CHEMBL3642122 US20130102619, 8 BDBM97377
Inchi Key	XADMHFYHZAIOGX-RHSMWYFYSA-N
Inchi ID	InChI=1S/C21H19FN6O2/c1-14-2-4-17(30-20-10-15(12-23)6-7-24-20)13-27(14)21(29)18-5-3-16(22)11-19(18)28-25-8-9-26-28/h3,5-11,14,17H,2,4,13H2,1H3/t14-,17-/m1/s1
PubChem CID	71526298
ChEMBL	CHEMBL3642122
IUPHAR	N/A
BindingDB	97377
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
386819	Orexin receptor type 1	P56718	Hcrtr1	Rattus norvegicus (Rat)	416
386822	Orexin receptor type 1	O43613	HCRTR1	Homo sapiens (Human)	425
386820	Orexin receptor type 2	O43614	HCRTR2	Homo sapiens (Human)	444
386821	Orexin receptor type 2	P56719	Hcrtr2	Rattus norvegicus (Rat)	460

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