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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	MLS000557950
Molecular formula	C19H27Cl2O4P
IUPAC name	(2,4-dichlorophenyl)-dicyclohexyloxyphosphorylmethanol
Molecular weight	421.295
Hydrogen bond acceptor	4
Hydrogen bond donor	1
XlogP	5.3
Synonyms	(2,4-dichlorophenyl)-dicyclohexyloxyphosphorylmethanol STL340496 HMS2410E18 AC1MWLNN MolPort-002-601-390 CHEMBL1466532 [(2,4-Dichloro-phenyl)-hydroxy-methyl]-phosphonic acid dicyclohexyl ester MCULE-2984059314 AKOS022141080 SMR000148666 dicyclohexyl [(2,4-dichlorophenyl)(hydroxy)methyl]phosphonate [ Show all ]
Inchi Key	AHFCAZQJWXOKOL-UHFFFAOYSA-N
Inchi ID	InChI=1S/C19H27Cl2O4P/c20-14-11-12-17(18(21)13-14)19(22)26(23,24-15-7-3-1-4-8-15)25-16-9-5-2-6-10-16/h11-13,15-16,19,22H,1-10H2
PubChem CID	3776201
ChEMBL	CHEMBL1466532
IUPHAR	N/A
BindingDB	N/A
DrugBank	N/A
Structure SDF download
Lipinski's druglikeness	This ligand has a partition coefficient log P greater than 5.

Experimental Data

Parameter	Value	Reference	Database source
Potency	31622.8 nM	PubChem BioAssay data set	ChEMBL

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