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GPCR

NameMas-related G-protein coupled receptor member X1
SpeciesHomo sapiens (Human)
GeneMRGPRX1
SynonymSensory neuron-specific G-protein coupled receptor 4
Sensory neuron-specific G-protein coupled receptor 3/4
MRGX1
MRGPRX1
Mrgprc11
[ Show all ]
DiseaseN/A
Length322
Amino acid sequenceMDPTISTLDTELTPINGTEETLCYKQTLSLTVLTCIVSLVGLTGNAVVLWLLGCRMRRNAFSIYILNLAAADFLFLSGRLIYSLLSFISIPHTISKILYPVMMFSYFAGLSFLSAVSTERCLSVLWPIWYRCHRPTHLSAVVCVLLWALSLLRSILEWMLCGFLFSGADSAWCQTSDFITVAWLIFLCVVLCGSSLVLLIRILCGSRKIPLTRLYVTILLTVLVFLLCGLPFGIQFFLFLWIHVDREVLFCHVHLVSIFLSALNSSANPIIYFFVGSFRQRQNRQNLKLVLQRALQDASEVDEGGGQLPEEILELSGSRLEQ
UniProtQ96LB2
Protein Data BankN/A
GPCR-HGmod modelQ96LB2
3D structure modelThis predicted structure model is from GPCR-EXP Q96LB2.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5850
IUPHAR156
DrugBankN/A

Ligand

NameCHEMBL3731811
Molecular formulaC28H29N
IUPAC name(3E)-2-benzhydryl-3-(2-phenylethylidene)-1-azabicyclo[2.2.2]octane
Molecular weight379.547
Hydrogen bond acceptor1
Hydrogen bond donor0
XlogP6.1
SynonymsL008650
Inchi KeyDTSJBNQOGPSNTC-YZSQISJMSA-N
Inchi IDInChI=1S/C28H29N/c1-4-10-22(11-5-1)16-17-26-23-18-20-29(21-19-23)28(26)27(24-12-6-2-7-13-24)25-14-8-3-9-15-25/h1-15,17,23,27-28H,16,18-21H2/b26-17+
PubChem CID11552633
ChEMBLCHEMBL3731811
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
IC50163.0 nMNoneChEMBL
IC501430.0 nMNoneChEMBL

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