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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	SMR000047194
Molecular formula	C16H9N5O3
IUPAC name	7-(5-methyl-1,2-oxazol-3-yl)-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Molecular weight	319.28
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	0.6
Synonyms	HMS2377L16 879945-78-5 MolPort-000-482-445 1-(5-methyl-1,2-oxazol-3-yl)-2,5-dioxodipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile BDBM30784 CHEMBL1362307 Z57904893 MCULE-9369325248 1-(5-methyl-1,2-oxazol-3-yl)-2,5-bis(oxidanylidene)dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile AC1LDEWH 1-(5-methyl-3-isoxazolyl)-2,5-dioxo-3-dipyrido[1,2-d:3'',4''-f]pyrimidinecarbonitrile C16H9N5O3 cid_665938 ZINC2433856 7-(5-methyl-1,2-oxazol-3-yl)-2,6-dioxo-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile MLS000084419 1-(5-methyl-1,2-oxazol-3-yl)-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile AKOS002239282 STK515347 2,5-diketo-1-(5-methylisoxazol-3-yl)dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile [ Show all ]
Inchi Key	CSWJXYZMNHKYEL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C16H9N5O3/c1-9-6-13(19-24-9)21-14-11(7-10(8-17)15(21)22)16(23)20-5-3-2-4-12(20)18-14/h2-7H,1H3
PubChem CID	665938
ChEMBL	CHEMBL1362307
IUPHAR	N/A
BindingDB	30784
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
49822	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
49820	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
49821	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378
49823	Sphingosine 1-phosphate receptor 4	O95977	S1PR4	Homo sapiens (Human)	384

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