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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	CHEMBL590956
Molecular formula	C21H12FN2O7S-
IUPAC name	1-amino-4-(2-carboxy-4-fluoroanilino)-9,10-dioxoanthracene-2-sulfonate
Molecular weight	455.392
Hydrogen bond acceptor	10
Hydrogen bond donor	3
XlogP	3.1
Synonyms	BDBM50307835 Sodium 1-amino-4-[4-fluoro-2-carboxyphenylamino]-9,10-dioxo-9,10-dihydroanthracene-2-sulfonate
Inchi Key	OBFSYBSKXOCXQH-UHFFFAOYSA-M
Inchi ID	InChI=1S/C21H13FN2O7S/c22-9-5-6-13(12(7-9)21(27)28)24-14-8-15(32(29,30)31)18(23)17-16(14)19(25)10-3-1-2-4-11(10)20(17)26/h1-8,24H,23H2,(H,27,28)(H,29,30,31)/p-1
PubChem CID	91934095
ChEMBL	N/A
IUPHAR	N/A
BindingDB	50307835
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
236962	P2Y purinoceptor 2	P41231	P2RY2	Homo sapiens (Human)	377
236960	P2Y purinoceptor 4	P51582	P2RY4	Homo sapiens (Human)	365
236961	P2Y purinoceptor 6	Q63371	P2ry6	Rattus norvegicus (Rat)	328

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