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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	ethyl 1-[(4-oxo-4H-pyrido[1,2-a]thieno[2,3-d]pyrimidin-2-yl)carbonyl]piperidine-4-carboxylate
Molecular formula	C19H19N3O4S
IUPAC name	ethyl 1-(2-oxo-6-thia-1,8-diazatricyclo[7.4.0.03,7]trideca-3(7),4,8,10,12-pentaene-5-carbonyl)piperidine-4-carboxylate
Molecular weight	385.438
Hydrogen bond acceptor	6
Hydrogen bond donor	0
XlogP	2.1
Synonyms	SR-01000296026-1 ethyl 1-{2-oxo-6-thia-1,8-diazatricyclo[7.4.0.0^{3,7}]trideca-3(7),4,8,10,12-pentaene-5-carbonyl}piperidine-4-carboxylate ZINC1063981 AKOS000810736 MCULE-9963109698 SMR000669343 CHEMBL1527795 STK979255 690250-25-0 EU-0057534 CHEBI:117112 MLS001124975 SR-01000296026 Z119980686 AC1LNW9M HMS2976H06 MolPort-000-370-446 [ Show all ]
Inchi Key	CCLUIZVVCMQXLS-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H19N3O4S/c1-2-26-19(25)12-6-9-21(10-7-12)18(24)14-11-13-16(27-14)20-15-5-3-4-8-22(15)17(13)23/h3-5,8,11-12H,2,6-7,9-10H2,1H3
PubChem CID	1253448
ChEMBL	CHEMBL1527795
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
38725	Glucagon-like peptide 1 receptor	P43220	GLP1R	Homo sapiens (Human)	463
38727	Relaxin receptor 1	Q9HBX9	RXFP1	Homo sapiens (Human)	757
38726	Relaxin receptor 2	Q8WXD0	RXFP2	Homo sapiens (Human)	754
38728	Vasopressin V1b receptor	P47901	AVPR1B	Homo sapiens (Human)	424

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