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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	SMR000154886
Molecular formula	C21H20N2O2
IUPAC name	(2Z)-1-(3-amino-1-benzofuran-2-yl)-2-(1,3,3-trimethylindol-2-ylidene)ethanone
Molecular weight	332.403
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	5.0
Synonyms	CHEBI:115107 (2Z)-1-(3-amino-2-benzofuranyl)-2-(1,3,3-trimethyl-2-indolylidene)ethanone cid_2456996 AC1M6XG7 (2Z)-1-(3-aminobenzofuran-2-yl)-2-(1,3,3-trimethylindolin-2-ylidene)ethanone HMS2305I05 BDBM44939 (2Z)-1-(3-amino-1-benzofuran-2-yl)-2-(1,3,3-trimethylindol-2-ylidene)ethanone CHEMBL1393243 (2Z)-1-(3-azanyl-1-benzofuran-2-yl)-2-(1,3,3-trimethylindol-2-ylidene)ethanone MLS000569228 [ Show all ]
Inchi Key	GTGGBHFTZAOINR-PDGQHHTCSA-N
Inchi ID	InChI=1S/C21H20N2O2/c1-21(2)14-9-5-6-10-15(14)23(3)18(21)12-16(24)20-19(22)13-8-4-7-11-17(13)25-20/h4-12H,22H2,1-3H3/b18-12-
PubChem CID	2456996
ChEMBL	CHEMBL1393243
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
104827	Lutropin-choriogonadotropic hormone receptor	P22888	LHCGR	Homo sapiens (Human)	699
104825	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
104826	Thyrotropin receptor	P16473	TSHR	Homo sapiens (Human)	764

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