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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

NameCHEMBL199035
Molecular formulaC33H33Cl2NO
IUPAC name4-(4-chlorophenyl)-1-[4-(4-chlorophenyl)-4-(4-phenylphenyl)butyl]piperidin-4-ol
Molecular weight530.533
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP8.4
SynonymsBDBM50027195
1-[4-Biphenyl-4-yl-4-(4-chloro-phenyl)-butyl]-4-(4-chloro-phenyl)-piperidin-4-ol
Inchi KeyROKXROUURNDTKR-UHFFFAOYSA-N
Inchi IDInChI=1S/C33H33Cl2NO/c34-30-16-12-28(13-17-30)32(27-10-8-26(9-11-27)25-5-2-1-3-6-25)7-4-22-36-23-20-33(37,21-24-36)29-14-18-31(35)19-15-29/h1-3,5-6,8-19,32,37H,4,7,20-24H2
PubChem CID11656660
ChEMBLCHEMBL199035
IUPHARN/A
BindingDB50027195
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
EC50<100000.0 nMPMID16190772BindingDB,ChEMBL
IC50<100000.0 nMPMID16190772BindingDB,ChEMBL

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