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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	CHEMBL243003
Molecular formula	C22H30N2O
IUPAC name	N-[[1-(1-azatricyclo[6.3.1.04,12]dodeca-2,4,6,8(12)-tetraen-3-yl)cyclohexyl]methyl]butanamide
Molecular weight	338.495
Hydrogen bond acceptor	1
Hydrogen bond donor	1
XlogP	4.6
Synonyms	BDBM50423061
Inchi Key	IQUVSIBCTHRJMK-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H30N2O/c1-2-8-20(25)23-16-22(12-4-3-5-13-22)19-15-24-14-7-10-17-9-6-11-18(19)21(17)24/h6,9,11,15H,2-5,7-8,10,12-14,16H2,1H3,(H,23,25)
PubChem CID	16743288
ChEMBL	CHEMBL243003
IUPHAR	N/A
BindingDB	50423061
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
139666	Melatonin receptor type 1A	P48039	MTNR1A	Homo sapiens (Human)	350
139665	Melatonin receptor type 1B	P49286	MTNR1B	Homo sapiens (Human)	362
139664	Melatonin receptor type 1C	P49219	mtnr1c	Xenopus laevis (African clawed frog)	420

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