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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	SCHEMBL17005219
Molecular formula	C17H15N7OS
IUPAC name	4-[(8R)-8-methyl-3-(3-methyl-1,2,4-thiadiazol-5-yl)-6,8-dihydro-5H-[1,2,4]triazolo[4,3-a]pyrazine-7-carbonyl]benzonitrile
Molecular weight	365.415
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	1.2
Synonyms	BDBM242763 US9422299, 29
Inchi Key	BYTHHHFQHHITDO-SNVBAGLBSA-N
Inchi ID	InChI=1S/C17H15N7OS/c1-10-14-20-21-15(16-19-11(2)22-26-16)24(14)8-7-23(10)17(25)13-5-3-12(9-18)4-6-13/h3-6,10H,7-8H2,1-2H3/t10-/m1/s1
PubChem CID	86275450
ChEMBL	N/A
IUPHAR	N/A
BindingDB	242763
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
558380	Neuromedin-K receptor	P29371	TACR3	Homo sapiens (Human)	465
558378	Substance-K receptor	P21452	TACR2	Homo sapiens (Human)	398
558379	Substance-P receptor	P25103	TACR1	Homo sapiens (Human)	407

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