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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	MLS000094258
Molecular formula	C15H10N4O2
IUPAC name	2,6-dioxo-7-prop-2-enyl-1,7,9-triazatricyclo[8.4.0.03,8]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile
Molecular weight	278.271
Hydrogen bond acceptor	4
Hydrogen bond donor	0
XlogP	0.5
Synonyms	2,5-dioxo-1-(prop-2-en-1-yl)-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile BDBM30862 MolPort-004-835-679 2,6-dioxo-7-(prop-2-en-1-yl)-1,7,9-triazatricyclo[8.4.0.0^{3,8}]tetradeca-3(8),4,9,11,13-pentaene-5-carbonitrile CHEMBL1300662 SR-01000100559-1 1-allyl-2,5-dioxo-1,5-dihydro-2H-dipyrido[1,2-a:2',3'-d]pyrimidine-3-carbonitrile AC1MMI7W MCULE-8304881098 ZINC4101572 2,5-dioxo-1-prop-2-enyl-3-dipyrido[1,2-d:3'',4''-f]pyrimidinecarbonitrile CCG-143052 SMR000029848 cid_3239161 STK906629 2,5-bis(oxidanylidene)-1-prop-2-enyl-dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile AKOS001868129 2,5-dioxo-1-prop-2-enyldipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile SR-01000100559 1-allyl-2,5-diketo-dipyrido[1,2-d:3'',4''-f]pyrimidine-3-carbonitrile 891034-44-9 HMS2189N04 Z1213746465 [ Show all ]
Inchi Key	ARCGSTOFFXSCJR-UHFFFAOYSA-N
Inchi ID	InChI=1S/C15H10N4O2/c1-2-6-19-13-11(8-10(9-16)14(19)20)15(21)18-7-4-3-5-12(18)17-13/h2-5,7-8H,1,6H2
PubChem CID	3239161
ChEMBL	CHEMBL1300662
IUPHAR	N/A
BindingDB	30862
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
12296	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
12298	Sphingosine 1-phosphate receptor 1	P21453	S1PR1	Homo sapiens (Human)	382
12299	Sphingosine 1-phosphate receptor 2	O95136	S1PR2	Homo sapiens (Human)	353
12295	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378
12297	Sphingosine 1-phosphate receptor 4	O95977	S1PR4	Homo sapiens (Human)	384

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