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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	MLS-0103364.0001
Molecular formula	C22H25NO3
IUPAC name	1-[3-(4-tert-butylphenoxy)propyl]-7-methylindole-2,3-dione
Molecular weight	351.446
Hydrogen bond acceptor	3
Hydrogen bond donor	0
XlogP	5.0
Synonyms	1-[3-(4-tert-butylphenoxy)propyl]-7-methyl-indole-2,3-dione AT-057/42304537 MLS000522284 1-{3-[4-(tert-butyl)phenoxy]propyl}-7-methylbenzo[d]azolidine-2,3-dione CHEMBL1522544 ST50080712 1-[3-(4-tert-butylphenoxy)propyl]-7-methyl-1H-indole-2,3-dione AC1MOO5A MCULE-9403189597 1-[3-(4-tert-butylphenoxy)propyl]-7-methyl-isatin BDBM83206 MolPort-000-262-800 Z57728788 620932-30-1 cid_3372218 1-[3-(4-tert-butylphenoxy)propyl]-7-methyl-2,3-dihydro-1H-indole-2,3-dione AKOS001203401 1-[3-(4-tert-butylphenoxy)propyl]-7-methylindole-2,3-dione SMR000127552 ZINC3647810 HMS2255O14 [ Show all ]
Inchi Key	PESHQZFOQZCWKC-UHFFFAOYSA-N
Inchi ID	InChI=1S/C22H25NO3/c1-15-7-5-8-18-19(15)23(21(25)20(18)24)13-6-14-26-17-11-9-16(10-12-17)22(2,3)4/h5,7-12H,6,13-14H2,1-4H3
PubChem CID	3372218
ChEMBL	CHEMBL1522544
IUPHAR	N/A
BindingDB	83206
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
257916	Apelin receptor	P35414	APLNR	Homo sapiens (Human)	380
257917	C-C chemokine receptor type 6	P51684	CCR6	Homo sapiens (Human)	374
257918	C-X-C chemokine receptor type 5	P32302	CXCR5	Homo sapiens (Human)	372
257915	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
494853	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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