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GPCR

NameNeuropeptide S receptor
SpeciesHomo sapiens (Human)
GeneNPSR1
SynonymNPS receptor
PGR14
GPR154
G-protein coupled receptor PGR14
G-protein coupled receptor for asthma susceptibility
[ 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

NameSCHEMBL2590676
Molecular formulaC28H22FN2OPS
IUPAC name3-diphenylphosphinothioyl-N-[(4-fluorophenyl)methyl]indole-1-carboxamide
Molecular weight484.529
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP7.2
SynonymsCHEMBL1436802
NCGC00185696-01
Inchi KeyADBHSOKUEXFGBH-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H22FN2OPS/c29-22-17-15-21(16-18-22)19-30-28(32)31-20-27(25-13-7-8-14-26(25)31)33(34,23-9-3-1-4-10-23)24-11-5-2-6-12-24/h1-18,20H,19H2,(H,30,32)
PubChem CID44634518
ChEMBLCHEMBL1436802
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Potency99597.3 nMPubChem BioAssay data setChEMBL

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