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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	NCGC00016051-01
Molecular formula	C13H8N4O3
IUPAC name	(3Z)-3-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,4-tricarbonitrile
Molecular weight	268.232
Hydrogen bond acceptor	7
Hydrogen bond donor	4
XlogP	0.2
Synonyms	NCGC00016051-04 EU-0101231 Lopac0_001231 NCGC00261916-01 (3Z)-3-amino-4-(3,4,5-trihydroxyphenyl)buta-1,3-diene-1,1,4-tricarbonitrile NCGC00016051-02 T 7665 HMS3263H04 NCGC00094473-01 LP01231 SR-01000076175 AC1O7G7I NCGC00016051-03 Tox21_501231 CHEMBL1376723 Lopac-T-7665 NCGC00094473-02 SR-01000076175-1 CCG-205305 [ Show all ]
Inchi Key	AURCEVGZZLSFSU-MDZDMXLPSA-N
Inchi ID	InChI=1S/C13H8N4O3/c14-4-7(5-15)1-10(17)9(6-16)8-2-11(18)13(20)12(19)3-8/h1-3,18-20H,17H2/b10-9+
PubChem CID	6604029
ChEMBL	CHEMBL1376723
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
14911	D(1A) dopamine receptor	P21728	DRD1	Homo sapiens (Human)	446
14910	Muscarinic acetylcholine receptor M1	P08482	Chrm1	Rattus norvegicus (Rat)	460
14912	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371

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