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GPCR

NameMelanocortin receptor 5
SpeciesHomo sapiens (Human)
GeneMC5R
Synonymmelanocortin receptor 5
MC5R
MC5-R
MC5 receptor
MC-2
DiseaseAcne vulgaris
Seborrhea
Length325
Amino acid sequenceMNSSFHLHFLDLNLNATEGNLSGPNVKNKSSPCEDMGIAVEVFLTLGVISLLENILVIGAIVKNKNLHSPMYFFVCSLAVADMLVSMSSAWETITIYLLNNKHLVIADAFVRHIDNVFDSMICISVVASMCSLLAIAVDRYVTIFYALRYHHIMTARRSGAIIAGIWAFCTGCGIVFILYSESTYVILCLISMFFAMLFLLVSLYIHMFLLARTHVKRIAALPGASSARQRTSMQGAVTVTMLLGVFTVCWAPFFLHLTLMLSCPQNLYCSRFMSHFNMYLILIMCNSVMDPLIYAFRSQEMRKTFKEIICCRGFRIACSFPRRD
UniProtP33032
Protein Data BankN/A
GPCR-HGmod modelP33032
3D structure modelThis predicted structure model is from GPCR-EXP P33032.
BioLiPN/A
Therapeutic Target DatabaseT95302
ChEMBLCHEMBL4608
IUPHAR286
DrugBankN/A

Ligand

NameSCHEMBL2344848
Molecular formulaC35H41N7O2
IUPAC name6-amino-N-[[(3S,5S)-3-[3-(diaminomethylideneamino)propyl]-1-(2,2-diphenylethyl)-2-oxo-1,4-diazepan-5-yl]methyl]naphthalene-2-carboxamide
Molecular weight591.76
Hydrogen bond acceptor5
Hydrogen bond donor5
XlogP3.7
SynonymsBDBM231831
US9340517, 218
CHEMBL3929750
Inchi KeyAHZLHBIQAMKSTD-CDZUIXILSA-N
Inchi IDInChI=1S/C35H41N7O2/c36-29-16-15-26-20-28(14-13-27(26)21-29)33(43)40-22-30-17-19-42(34(44)32(41-30)12-7-18-39-35(37)38)23-31(24-8-3-1-4-9-24)25-10-5-2-6-11-25/h1-6,8-11,13-16,20-21,30-32,41H,7,12,17-19,22-23,36H2,(H,40,43)(H4,37,38,39)/t30-,32-/m0/s1
PubChem CID57854107
ChEMBLCHEMBL3929750
IUPHARN/A
BindingDB231831
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
IC50>10000.0 nM, NoneBindingDB,ChEMBL

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