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GLASS

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Go to the GPCR, ligand, or experimental data tables.
Go to the experimental data table for text mining information in PubMed ID column.
Go to the GPCR page and check other ligands which interact with it.
Go to the ligand page and check other GPCRs which it interacts with.
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GPCR

Name	Neuropeptide S receptor
Species	Mus musculus (Mouse)
Gene	Npsr1
Synonym	vasopressin receptor-related receptor 1 PGR14 NPS receptor GPR154 G-protein coupled receptor PGR14 G-protein coupled receptor 154 G protein-coupled receptor 154 VRR1 [ Show all ]
Disease	N/A for non-human GPCRs
Length	371
Amino acid sequence	MPANLTEGSFHANQTVPMLDSSPVACTEIVTFTEALVAEEWGSFYSSFKTEQLITLWVLFVVTIVGNSVVLFSTCRRKRKSRMTFFVTQLAITDSFTGLINILTDIIWRFTGDFMAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQAKVLIGIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLAIISVIYGLVIRTIWMKSKTHETVISNCSDGKLCCSYNRGLISKAKIKAIKYSIVIILAFICCWSPYFLFDILDNFNVLPDTKERFYASVIIQNLPALNSAINPLIYCIFSSSICSPCKMQRSQDSRMTYRERSERHEMQILSKPEFI
UniProt	Q8BZP8
Protein Data Bank	N/A
GPCR-HGmod model	N/A
3D structure model	No available structures or models
BioLiP	N/A
Therapeutic Target Database	N/A
ChEMBL	CHEMBL5497
IUPHAR	302
DrugBank	N/A

Ligand

Name	CHEMBL1765704
Molecular formula	C26H24FN3O3
IUPAC name	(8aS)-N-[(4-fluorophenyl)methyl]-3-oxo-1,1-diphenyl-5,6,8,8a-tetrahydro-[1,3]oxazolo[3,4-a]pyrazine-7-carboxamide
Molecular weight	445.494
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	3.7
Synonyms	ZINC40895708
Inchi Key	SFRQIPRTNYHJHP-QHCPKHFHSA-N
Inchi ID	InChI=1S/C26H24FN3O3/c27-22-13-11-19(12-14-22)17-28-24(31)29-15-16-30-23(18-29)26(33-25(30)32,20-7-3-1-4-8-20)21-9-5-2-6-10-21/h1-14,23H,15-18H2,(H,28,31)/t23-/m0/s1
PubChem CID	52951680
ChEMBL	CHEMBL1765704
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand satisfies Lipinski's rule of five.

Experimental Data

Parameter	Value	Reference	Database source
pKb	>6.0 -	PMID21466221	ChEMBL

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