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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	SMR000091760
Molecular formula	C20H15N5O3S
IUPAC name	2-[1-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl]isoindole-1,3-dione
Molecular weight	405.432
Hydrogen bond acceptor	7
Hydrogen bond donor	0
XlogP	2.8
Synonyms	BDBM42483 MLS002585277 2-[1-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl]isoindole-1,3-dione 2-{[3-(4-methoxyphenyl)-1,2,4-triazolo[3,4-b]1,3,4-thiadiazolin-6-yl]ethyl}ben zo[c]azoline-1,3-dione cid_4246341 Oprea1_668724 AC1N75F9 MCULE-8481413604 ST50426674 MolPort-006-757-831 2-[1-[3-(4-methoxyphenyl)-[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl]isoindoline-1,3-quinone HMS1652J04 REGID_for_CID_4246341 AKOS001675528 MLS000114360 CHEMBL1360426 NCGC00086130-02 2-{1-[3-(4-methoxyphenyl)[1,2,4]triazolo[3,4-b][1,3,4]thiadiazol-6-yl]ethyl}-1H-isoindole-1,3(2H)-dione AB00429613-11 HMS2260G16 [ Show all ]
Inchi Key	ABAGTJARVQFMJH-UHFFFAOYSA-N
Inchi ID	InChI=1S/C20H15N5O3S/c1-11(24-18(26)14-5-3-4-6-15(14)19(24)27)17-23-25-16(21-22-20(25)29-17)12-7-9-13(28-2)10-8-12/h3-11H,1-2H3
PubChem CID	4246341
ChEMBL	CHEMBL1360426
IUPHAR	N/A
BindingDB	42483
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
687	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
685	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
686	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381
463028	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593

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