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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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Go to the ligand page and check other GPCRs which it interacts with.
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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	SMR000221222
Molecular formula	C34H29N3O3
IUPAC name	None
Molecular weight	527.624
Hydrogen bond acceptor	4
Hydrogen bond donor	2
XlogP	4.9
Synonyms	AKOS032395645 MLS003904059 CHEMBL1461508 MCULE-2488468941 BDBM79541 MolPort-002-645-906 cid_4898241 AC1NL2K7 MLS000331108 1005072-60-5 HMS2568C12 [ Show all ]
Inchi Key	DEXFPUZLJYSAEO-UHFFFAOYSA-N
Inchi ID	InChI=1S/C34H29N3O3/c1-2-20-13-16-27-25(18-20)34(32(40)36-27)33(24-10-5-6-11-26(24)35-31(33)39)29(28-12-7-17-37(28)34)30(38)23-15-14-21-8-3-4-9-22(21)19-23/h3-6,8-11,13-16,18-19,28-29H,2,7,12,17H2,1H3,(H,35,39)(H,36,40)
PubChem CID	4898241
ChEMBL	CHEMBL1461508
IUPHAR	N/A
BindingDB	79541
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand is heavier than 500 daltons.

Experimental Data

Parameter	Value	Reference	Database source
Potency	5011.9 nM	PubChem BioAssay data set	ChEMBL

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