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GPCR

NameG-protein coupled receptor homolog US28
SpeciesHuman cytomegalovirus (strain AD169) (HHV-5)
GeneUS28
SynonymHHRF3
DiseaseN/A for non-human GPCRs
Length354
Amino acid sequenceMTPTTTTAELTTEFDYDEDATPCVFTDVLNQSKPVTLFLYGVVFLFGSIGNFLVIFTITWRRRIQCSGDVYFINLAAADLLFVCTLPLWMQYLLDHNSLASVPCTLLTACFYVAMFASLCFITEIALDRYYAIVYMRYRPVKQACLFSIFWWIFAVIIAIPHFMVVTKKDNQCMTDYDYLEVSYPIILNVELMLGAFVIPLSVISYCYYRISRIVAVSQSRHKGRIVRVLIAVVLVFIIFWLPYHLTLFVDTLKLLKWISSSCEFERSLKRALILTESLAFCHCCLNPLLYVFVGTKFRQELHCLLAEFRQRLFSRDVSWYHSMSFSRRSSPSRRETSSDTLSDEVCRVSQIIP
UniProtP69332
Protein Data Bank4xt1
GPCR-HGmod modelN/A
3D structure modelThis structure is from PDB ID 4xt1.
BioLiPBL0309402,BL0309403
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4259
IUPHARN/A
DrugBankN/A

Ligand

Namedihydroisoquinolinone
Molecular formulaC25H41N3O2
IUPAC nameN-[2-(dimethylamino)ethyl]-N-[(3-methyl-1-oxo-2,4-dihydroisoquinolin-3-yl)methyl]decanamide
Molecular weight415.622
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP5.1
SynonymsCHEMBL1824269
SCHEMBL16948653
N-(2-dimethylaminoethyl)-N-[(3-methyl-1-oxo-2,4-dihydroisoquinolin-3-yl)methyl]decanamide
Inchi KeyWGLUNLJVYNJMBU-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H41N3O2/c1-5-6-7-8-9-10-11-16-23(29)28(18-17-27(3)4)20-25(2)19-21-14-12-13-15-22(21)24(30)26-25/h12-15H,5-11,16-20H2,1-4H3,(H,26,30)
PubChem CID56668956
ChEMBLCHEMBL1824269
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
EC501500.0 nMPMID25052428ChEMBL
EC501513.56 nMPMID25052428ChEMBL
Efficacy-20.0 %PMID25052428ChEMBL

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