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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	SMR000117962
Molecular formula	C24H25N5O4S
IUPAC name	N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-1,2,5-thiadiazole-3-carboxamide
Molecular weight	479.555
Hydrogen bond acceptor	8
Hydrogen bond donor	1
XlogP	3.2
Synonyms	CHEMBL1609697 Oprea1_282264 MLS000527488 [1,2,5]Thiadiazole-3-carboxylic acid benzo[1,3]dioxol-5-ylmethyl-(cyclohexylcarbamoyl-pyridin-4-yl-methyl)-amide BDBM42417 N-[2-(cyclohexylamino)-2-keto-1-(4-pyridyl)ethyl]-N-piperonyl-1,2,5-thiadiazole-3-carboxamide cid_3200707 REGID_for_CID_3200707 AC1MK95Z N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxidanylidene-1-pyridin-4-yl-ethyl]-1,2,5-thiadiazole-3-carboxamide Oprea1_231547 HMS2299O03 ASN 05304140 N-(1,3-benzodioxol-5-ylmethyl)-N-[2-(cyclohexylamino)-2-oxo-1-pyridin-4-ylethyl]-1,2,5-thiadiazole-3-carboxamide [ Show all ]
Inchi Key	BGSVSADZEMUBIT-UHFFFAOYSA-N
Inchi ID	InChI=1S/C24H25N5O4S/c30-23(27-18-4-2-1-3-5-18)22(17-8-10-25-11-9-17)29(24(31)19-13-26-34-28-19)14-16-6-7-20-21(12-16)33-15-32-20/h6-13,18,22H,1-5,14-15H2,(H,27,30)
PubChem CID	3200707
ChEMBL	CHEMBL1609697
IUPHAR	N/A
BindingDB	42417
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
23393	Melanin-concentrating hormone receptor 1	Q99705	MCHR1	Homo sapiens (Human)	422
23394	Neuropeptide Y receptor type 1	P25929	NPY1R	Homo sapiens (Human)	384
23395	Neuropeptide Y receptor type 2	P49146	NPY2R	Homo sapiens (Human)	381
23392	Neuropeptides B/W receptor type 1	P48145	NPBWR1	Homo sapiens (Human)	328

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