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GPCR

NameNeuropeptide S receptor
SpeciesHomo sapiens (Human)
GeneNPSR1
SynonymG-protein coupled receptor for asthma susceptibility
vasopressin receptor-related receptor 1
G protein-coupled receptor 154
PGR14
NPS receptor
[ Show all ]
DiseaseNeurological disease
Length371
Amino acid sequenceMPANFTEGSFDSSGTGQTLDSSPVACTETVTFTEVVEGKEWGSFYYSFKTEQLITLWVLFVFTIVGNSVVLFSTWRRKKKSRMTFFVTQLAITDSFTGLVNILTDINWRFTGDFTAPDLVCRVVRYLQVVLLYASTYVLVSLSIDRYHAIVYPMKFLQGEKQARVLIVIAWSLSFLFSIPTLIIFGKRTLSNGEVQCWALWPDDSYWTPYMTIVAFLVYFIPLTIISIMYGIVIRTIWIKSKTYETVISNCSDGKLCSSYNRGLISKAKIKAIKYSIIIILAFICCWSPYFLFDILDNFNLLPDTQERFYASVIIQNLPALNSAINPLIYCVFSSSISFPCREQRSQDSRMTFRERTERHEMQILSKPEFI
UniProtQ6W5P4
Protein Data BankN/A
GPCR-HGmod modelQ6W5P4
3D structure modelThis predicted structure model is from GPCR-EXP Q6W5P4.
BioLiPN/A
Therapeutic Target DatabaseT20958
ChEMBLCHEMBL5162
IUPHAR302
DrugBankBE0000948

Ligand

NameMLS000526556
Molecular formulaC21H22N2O
IUPAC name[4-(dimethylamino)naphthalen-1-yl]-[4-(dimethylamino)phenyl]methanone
Molecular weight318.42
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.8
SynonymsBAS 00399020
Oprea1_065310
[4-(dimethylamino)-1-naphthyl][4-(dimethylamino)phenyl]methanone
CHEMBL460601
SR-01000420892
[ Show all ]
Inchi KeyAGCZLPSWSLXJRK-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H22N2O/c1-22(2)16-11-9-15(10-12-16)21(24)19-13-14-20(23(3)4)18-8-6-5-7-17(18)19/h5-14H,1-4H3
PubChem CID815398
ChEMBLCHEMBL460601
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
Potency199.5 nMPubChem BioAssay data setChEMBL

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