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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	CHEMBL3818200
Molecular formula	C20H20N2O
IUPAC name	4-[4-(3,4-dihydro-1H-isoquinolin-2-yl)butanoyl]benzonitrile
Molecular weight	304.393
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	3.2
Synonyms	BDBM50182749 SCHEMBL20359913
Inchi Key	JPXQQLVVAAHNSC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H20N2O/c21-14-16-7-9-18(10-8-16)20(23)6-3-12-22-13-11-17-4-1-2-5-19(17)15-22/h1-2,4-5,7-10H,3,6,11-13,15H2
PubChem CID	127051843
ChEMBL	CHEMBL3818200
IUPHAR	N/A
BindingDB	50182749
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
525990	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
525994	5-hydroxytryptamine receptor 2A	P28223	HTR2A	Homo sapiens (Human)	471
525992	5-hydroxytryptamine receptor 2B	P41595	HTR2B	Homo sapiens (Human)	481
525993	5-hydroxytryptamine receptor 2C	P08909	Htr2c	Rattus norvegicus (Rat)	460
525991	5-hydroxytryptamine receptor 7	P34969	HTR7	Homo sapiens (Human)	479
525989	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
525988	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400
525986	D(4) dopamine receptor	P30729	Drd4	Rattus norvegicus (Rat)	387
525987	Histamine H1 receptor	P35367	HRH1	Homo sapiens (Human)	487

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