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GLASS

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Go to the GPCR, ligand, or experimental data tables.
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GPCR

Name	Neuropeptide S receptor
Species	Homo sapiens (Human)
Gene	NPSR1
Synonym	G-protein coupled receptor for asthma susceptibility vasopressin receptor-related receptor 1 G protein-coupled receptor 154 PGR14 NPS receptor G-protein coupled receptor 154 GPR154 G-protein coupled receptor PGR14 VRR1 [ Show all ]
Disease	Neurological disease
Length	371
Amino acid sequence	MPANFTEGSFDSSGTGQTLDSSPVACTETVTFTEVVEGKEWGSFYYSFKTEQLITLWVLFVFTIVGNSVVLFSTWRRKKKSRMTFFVTQLAITDSFTGLVNILTDINWRFTGDFTAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQARVLIVIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLTIISIMYGIVIRTIWIKSKTYETVISNCSDGKLCSSYNRGLISKAKIKAIKYSIIIILAFICCWSPYFLFDILDNFNLLPDTQERFYASVIIQNLPALNSAINPLIYCVFSSSISFPCREQRSQDSRMTFRERTERHEMQILSKPEFI
UniProt	Q6W5P4
Protein Data Bank	N/A
GPCR-HGmod model	Q6W5P4
3D structure model	This predicted structure model is from GPCR-EXP Q6W5P4.
BioLiP	N/A
Therapeutic Target Database	T20958
ChEMBL	CHEMBL5162
IUPHAR	302
DrugBank	BE0000948

Ligand

Name	4-hydroxy-2-oxo-N'-[(E)-phenylmethylidene]-1,2-dihydroquinoline-3-carbohydrazide
Molecular formula	C17H13N3O3
IUPAC name	N-[(E)-benzylideneamino]-4-hydroxy-2-oxo-1H-quinoline-3-carboxamide
Molecular weight	307.309
Hydrogen bond acceptor	4
Hydrogen bond donor	3
XlogP	2.9
Synonyms	AKOS005385499 MLS000589876 SMR000217037 300589-76-8 MolPort-002-537-481 AC1OBNVH STK052696 CHEMBL3191933 4-Hydroxy-2-oxo-1,2-dihydro-quinoline-3-carboxylic acid [1-phenyl-meth-(E)-ylidene]-hydrazide N-[(E)-benzylideneamino]-2-hydroxy-4-oxo-1H-quinoline-3-carboxamide [ Show all ]
Inchi Key	ADDZLKKZKXLNRZ-VCHYOVAHSA-N
Inchi ID	InChI=1S/C17H13N3O3/c21-15-12-8-4-5-9-13(12)19-16(22)14(15)17(23)20-18-10-11-6-2-1-3-7-11/h1-10H,(H,20,23)(H2,19,21,22)/b18-10+
PubChem CID	54725416
ChEMBL	CHEMBL3191933
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
Potency	10000.0 nM	PubChem BioAssay data set	ChEMBL

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