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GPCR

NameMelanocortin receptor 3
SpeciesHomo sapiens (Human)
GeneMC3R
SynonymMC3-R
melanocortin receptor 3
MC3 receptor
gamma-MSH receptor
DiseaseSexual dysfunction; Obesity; Type 2 diabetes
Length323
Amino acid sequenceMNASCCLPSVQPTLPNGSEHLQAPFFSNQSSSAFCEQVFIKPEVFLSLGIVSLLENILVILAVVRNGNLHSPMYFFLCSLAVADMLVSVSNALETIMIAIVHSDYLTFEDQFIQHMDNIFDSMICISLVASICNLLAIAVDRYVTIFYALRYHSIMTVRKALTLIVAIWVCCGVCGVVFIVYSESKMVIVCLITMFFAMMLLMGTLYVHMFLFARLHVKRIAALPPADGVAPQQHSCMKGAVTITILLGVFIFCWAPFFLHLVLIITCPTNPYCICYTAHFNTYLVLIMCNSVIDPLIYAFRSLELRNTFREILCGCNGMNLG
UniProtP41968
Protein Data BankN/A
GPCR-HGmod modelP41968
3D structure modelThis predicted structure model is from GPCR-EXP P41968.
BioLiPN/A
Therapeutic Target DatabaseT76846
ChEMBLCHEMBL4644
IUPHAR284
DrugBankN/A

Ligand

NameCHEMBL237052
Molecular formulaC24H31N3O
IUPAC nameN-(5-aminopentyl)-2-(1H-indol-3-yl)-N-(3-phenylpropyl)acetamide
Molecular weight377.532
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP3.8
SynonymsBDBM50217719
N-(5-aminopentyl)-2-(1H-indol-3-yl)-N-(3-phenylpropyl)acetamide
Inchi KeyBFBYTEMHUBFYBD-UHFFFAOYSA-N
Inchi IDInChI=1S/C24H31N3O/c25-15-7-2-8-16-27(17-9-12-20-10-3-1-4-11-20)24(28)18-21-19-26-23-14-6-5-13-22(21)23/h1,3-6,10-11,13-14,19,26H,2,7-9,12,15-18,25H2
PubChem CID44434637
ChEMBLCHEMBL237052
IUPHARN/A
BindingDB50217719
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki47000.0 nMPMID17618123BindingDB,ChEMBL

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