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GPCR

NameMelanocortin receptor 4
SpeciesHomo sapiens (Human)
GeneMC4R
SynonymMC4-R
MC4 receptor
DiseaseObesity; Sexual dysfunction
Obesity; Diabetes
Obesity
Metabolic disorders
Sexual dysfunction
[ Show all ]
Length332
Amino acid sequenceMVNSTHRGMHTSLHLWNRSSYRLHSNASESLGKGYSDGGCYEQLFVSPEVFVTLGVISLLENILVIVAIAKNKNLHSPMYFFICSLAVADMLVSVSNGSETIVITLLNSTDTDAQSFTVNIDNVIDSVICSSLLASICSLLSIAVDRYFTIFYALQYHNIMTVKRVGIIISCIWAACTVSGILFIIYSDSSAVIICLITMFFTMLALMASLYVHMFLMARLHIKRIAVLPGTGAIRQGANMKGAITLTILIGVFVVCWAPFFLHLIFYISCPQNPYCVCFMSHFNLYLILIMCNSIIDPLIYALRSQELRKTFKEIICCYPLGGLCDLSSRY
UniProtP32245
Protein Data BankN/A
GPCR-HGmod modelP32245
3D structure modelThis predicted structure model is from GPCR-EXP P32245.
BioLiPN/A
Therapeutic Target DatabaseT72458
ChEMBLCHEMBL259
IUPHAR285
DrugBankN/A

Ligand

NameCHEMBL2035935
Molecular formulaC20H23N3O2
IUPAC name(3S,4S)-3-N,4-N-dibenzylpyrrolidine-3,4-dicarboxamide
Molecular weight337.423
Hydrogen bond acceptor3
Hydrogen bond donor3
XlogP1.1
SynonymsBDBM50385156
Inchi KeyACFLFTASFIWDPS-QZTJIDSGSA-N
Inchi IDInChI=1S/C20H23N3O2/c24-19(22-11-15-7-3-1-4-8-15)17-13-21-14-18(17)20(25)23-12-16-9-5-2-6-10-16/h1-10,17-18,21H,11-14H2,(H,22,24)(H,23,25)/t17-,18-/m1/s1
PubChem CID70685980
ChEMBLCHEMBL2035935
IUPHARN/A
BindingDB50385156
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki900.0 nMPMID22551631BindingDB,ChEMBL

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