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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	MLS-0437133.0001
Molecular formula	C24H28N4O2S
IUPAC name	2-(3-methylphenoxy)-1-[4-(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone
Molecular weight	436.574
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	5.0
Synonyms	BDBM76034 2-(3-methylphenoxy)-1-[4-(2-methyl-5,6,7,8-tetrahydrobenzothiopheno[2,3-d]pyrimidin-4-yl)piperazino]ethanone cid_1434959 AKOS000704470 Oprea1_374471 2-(3-methylphenoxy)-1-[4-(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)-1-piperazinyl]ethanone ASN 04888297 2-(3-methylphenoxy)-1-[4-(2-methyl-5,6,7,8-tetrahydro-[1]benzothiolo[2,3-d]pyrimidin-4-yl)piperazin-1-yl]ethanone CHEMBL1725686 AC1LS8DE Oprea1_306913 [ Show all ]
Inchi Key	GBBFDWPPCQLGGT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H28N4O2S/c1-16-6-5-7-18(14-16)30-15-21(29)27-10-12-28(13-11-27)23-22-19-8-3-4-9-20(19)31-24(22)26-17(2)25-23/h5-7,14H,3-4,8-13,15H2,1-2H3
PubChem CID	1434959
ChEMBL	CHEMBL1725686
IUPHAR	N/A
BindingDB	76034
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
92118	Cannabinoid receptor 1	P21554	CNR1	Homo sapiens (Human)	472
92117	Cannabinoid receptor 2	P34972	CNR2	Homo sapiens (Human)	360
92116	G-protein coupled receptor 35	Q9HC97	GPR35	Homo sapiens (Human)	309
92119	G-protein coupled receptor 55	Q9Y2T6	GPR55	Homo sapiens (Human)	319

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