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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	SMR000147833
Molecular formula	C18H14N6OS
IUPAC name	4,6-diamino-8-imino-12-oxo-14-phenyl-9-thia-3,11-diazatricyclo[8.4.0.02,7]tetradeca-1(10),2(7),3,5-tetraene-5-carbonitrile
Molecular weight	362.411
Hydrogen bond acceptor	7
Hydrogen bond donor	4
XlogP	1.1
Synonyms	647830-20-4 MLS000556516 REGID_for_CID_5900673 2,4-diamino-5-imino-8-oxo-10-phenyl-7,8,9,10-tetrahydro-5H-thiopyrano[2,3-b:4,5-b']dipyridine-3-carbonitrile HMS2387O20 AKOS005479025 MolPort-002-586-007 CHEMBL1556915 6,8-Diamino-9-imino-2-oxo-4-phenyl-1,3,4,9-tetrahydro-2H-10-thia-1,5-diaza-phenanthrene-7-carbonitr ile MCULE-3996618366 BDBM63072 MolPort-005-972-428 cid_5900673 STK551756 [ Show all ]
Inchi Key	DKEHVXLGLYZRNF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C18H14N6OS/c19-7-10-14(20)13-15(24-16(10)21)12-9(8-4-2-1-3-5-8)6-11(25)23-18(12)26-17(13)22/h1-5,9,22H,6H2,(H,23,25)(H4,20,21,24)
PubChem CID	3708288
ChEMBL	CHEMBL1556915
IUPHAR	N/A
BindingDB	N/A
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
559187	Galanin receptor type 3	O60755	GALR3	Homo sapiens (Human)	368
559186	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
559189	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
559188	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757

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