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GPCR

NameMelanocyte-stimulating hormone receptor
SpeciesMus musculus (Mouse)
GeneMc1r
SynonymMC1 receptor
MC1-R
melanocortin 1 receptor (alpha melanocyte stimulating hormone receptor)
Melanocortin receptor 1
MSH-R
DiseaseN/A for non-human GPCRs
Length315
Amino acid sequenceMSTQEPQKSLLGSLNSNATSHLGLATNQSEPWCLYVSIPDGLFLSLGLVSLVENVLVVIAITKNRNLHSPMYYFICCLALSDLMVSVSIVLETTIILLLEAGILVARVALVQQLDNLIDVLICGSMVSSLCFLGIIAIDRYISIFYALRYHSIVTLPRARRAVVGIWMVSIVSSTLFITYYKHTAVLLCLVTFFLAMLALMAILYAHMFTRACQHAQGIAQLHKRRRSIRQGFCLKGAATLTILLGIFFLCWGPFFLHLLLIVLCPQHPTCSCIFKNFNLFLLLIVLSSTVDPLIYAFRSQELRMTLKEVLLCSW
UniProtQ01727
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4077
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL393557
Molecular formulaC26H35N3O
IUPAC nameN-(5-aminopentyl)-4-(1H-indol-3-yl)-N-(3-phenylpropyl)butanamide
Molecular weight405.586
Hydrogen bond acceptor2
Hydrogen bond donor2
XlogP4.7
SynonymsBDBM50217699
N-(5-aminopentyl)-4-(1H-indol-3-yl)-N-(3-phenylpropyl)butanamide
Inchi KeyCFZBOPYQAMXMKM-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H35N3O/c27-18-7-2-8-19-29(20-10-13-22-11-3-1-4-12-22)26(30)17-9-14-23-21-28-25-16-6-5-15-24(23)25/h1,3-6,11-12,15-16,21,28H,2,7-10,13-14,17-20,27H2
PubChem CID44434639
ChEMBLCHEMBL393557
IUPHARN/A
BindingDB50217699
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki18000.0 nMPMID17618123BindingDB,ChEMBL

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