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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	SMR000019649
Molecular formula	C25H29N3O4S
IUPAC name	ethyl 1-[[2-(furan-2-carbonylamino)-4,5-dimethylthiophen-3-yl]-pyridin-3-ylmethyl]piperidine-4-carboxylate
Molecular weight	467.584
Hydrogen bond acceptor	7
Hydrogen bond donor	1
XlogP	4.1
Synonyms	AC1MMWBN ethyl 1-[[2-(2-furoylamino)-4,5-dimethylthien-3-yl](pyridin-3-yl)methyl]piperidine-4-carboxylate MLS000085109 BDBM31031 ethyl 1-[{2-[(furan-2-ylcarbonyl)amino]-4,5-dimethylthiophen-3-yl}(pyridin-3-yl)methyl]piperidine-4-carboxylate MolPort-000-226-593 STL487521 cid_3245442 HMS2427I04 AKOS000808919 ethyl 1-[[2-(furan-2-carbonylamino)-4,5-dimethylthiophen-3-yl]-pyridin-3-ylmethyl]piperidine-4-carboxylate MLS000085109-02 1-[[2-(2-furoylamino)-4,5-dimethyl-3-thienyl]-(3-pyridyl)methyl]isonipecotic acid ethyl ester ethyl 1-{[2-(2-furylcarbonylamino)-4,5-dimethyl(3-thienyl)]-3-pyridylmethyl}pi peridine-4-carboxylate 618404-65-2 ethyl 1-((2-(furan-2-carboxamido)-4,5-dimethylthiophen-3-yl)(pyridin-3-yl)methyl)piperidine-4-carboxylate MCULE-3983104503 AKOS016074485 ethyl 1-[[2-(furan-2-ylcarbonylamino)-4,5-dimethyl-thiophen-3-yl]-pyridin-3-yl-methyl]piperidine-4-carboxylate MLS002585297 ST50073017 1-[[2-[[2-furanyl(oxo)methyl]amino]-4,5-dimethyl-3-thiophenyl]-(3-pyridinyl)methyl]-4-piperidinecarboxylic acid ethyl ester CHEMBL1477013 F1396-0115 [ Show all ]
Inchi Key	FYETUTFFCYTDPF-UHFFFAOYSA-N
Inchi ID	InChI=1S/C25H29N3O4S/c1-4-31-25(30)18-9-12-28(13-10-18)22(19-7-5-11-26-15-19)21-16(2)17(3)33-24(21)27-23(29)20-8-6-14-32-20/h5-8,11,14-15,18,22H,4,9-10,12-13H2,1-3H3,(H,27,29)
PubChem CID	3245442
ChEMBL	CHEMBL1477013
IUPHAR	N/A
BindingDB	31031
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
90161	5-hydroxytryptamine receptor 1A	P08908	HTR1A	Homo sapiens (Human)	422
90159	5-hydroxytryptamine receptor 1E	P28566	HTR1E	Homo sapiens (Human)	365
90163	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
90160	Neuropeptide S receptor	Q6W5P4	NPSR1	Homo sapiens (Human)	371
474031	Parathyroid hormone/parathyroid hormone-related peptide receptor	Q03431	PTH1R	Homo sapiens (Human)	593
90162	Sphingosine 1-phosphate receptor 3	Q99500	S1PR3	Homo sapiens (Human)	378

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