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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.
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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	AC1NY53V
Molecular formula	C18H15N3O3
IUPAC name	2-[3-[(Z)-2-nitroethenyl]indol-1-yl]-N-phenylacetamide
Molecular weight	321.336
Hydrogen bond acceptor	3
Hydrogen bond donor	1
XlogP	3.3
Synonyms	ZINC4746817 2-[3-[(Z)-2-nitroethenyl]indol-1-yl]-N-phenylacetamide MLS000708937 AKOS000610252 SMR000289704 CHEMBL1568934 2-{3-[(Z)-2-nitroethenyl]-1H-indol-1-yl}-N-phenylacetamide MolPort-001-971-680 BAS 02050098 STK208795 HMS2766B12 2-[3-((Z)-2-Nitro-vinyl)-indol-1-yl]-N-phenyl-acetamide Oprea1_748913 [ Show all ]
Inchi Key	ADXBIMIKLYJREK-KHPPLWFESA-N
Inchi ID	InChI=1S/C18H15N3O3/c22-18(19-15-6-2-1-3-7-15)13-20-12-14(10-11-21(23)24)16-8-4-5-9-17(16)20/h1-12H,13H2,(H,19,22)/b11-10-
PubChem CID	5765586
ChEMBL	CHEMBL1568934
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	12589.3 nM	PubChem BioAssay data set	ChEMBL

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