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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	CHEMBL301475
Molecular formula	C25H26F3N3O4S
IUPAC name	[2-[4-[[(E)-3-(1H-indol-3-yl)prop-2-enoyl]amino]butyl]-3,4-dihydro-1H-isoquinolin-7-yl] trifluoromethanesulfonate
Molecular weight	521.555
Hydrogen bond acceptor	8
Hydrogen bond donor	2
XlogP	4.8
Synonyms	SCHEMBL7855330 BDBM50217168 L017930 Trifluoromethanesulfonic acid 2-[4-[[(E)-3-(1H-indole-3-yl)acryloyl]amino]butyl]-1,2,3,4-tetrahydroisoquinoline-7-yl ester SCHEMBL7853940
Inchi Key	AFKRYMMWFODFAD-CSKARUKUSA-N
Inchi ID	InChI=1S/C25H26F3N3O4S/c26-25(27,28)36(33,34)35-21-9-7-18-11-14-31(17-20(18)15-21)13-4-3-12-29-24(32)10-8-19-16-30-23-6-2-1-5-22(19)23/h1-2,5-10,15-16,30H,3-4,11-14,17H2,(H,29,32)/b10-8+
PubChem CID	22132503
ChEMBL	CHEMBL301475
IUPHAR	N/A
BindingDB	50217168
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
4244	D(2) dopamine receptor	P14416	DRD2	Homo sapiens (Human)	443
4243	D(3) dopamine receptor	P35462	DRD3	Homo sapiens (Human)	400

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