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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

NameCHEMBL198505
Molecular formulaC28H29ClN2
IUPAC name5-[4-(4-chlorophenyl)piperidin-1-yl]-2,2-diphenylpentanenitrile
Molecular weight429.004
Hydrogen bond acceptor2
Hydrogen bond donor0
XlogP6.7
SynonymsBDBM50027204
VUF-5662
5-[4-(4-Chloro-phenyl)-piperidin-1-yl]-2,2-diphenyl-pentanenitrile
Inchi KeyJFDZJGIBIWMOJQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C28H29ClN2/c29-27-14-12-23(13-15-27)24-16-20-31(21-17-24)19-7-18-28(22-30,25-8-3-1-4-9-25)26-10-5-2-6-11-26/h1-6,8-15,24H,7,16-21H2
PubChem CID10410351
ChEMBLCHEMBL198505
IUPHARN/A
BindingDB50027204
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
EC5013800.0 nMPMID16190772BindingDB,ChEMBL
IC5010500.0 nMPMID16190772BindingDB,ChEMBL

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