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GPCR

NameC-C chemokine receptor type 3
SpeciesHomo sapiens (Human)
GeneCCR3
SynonymMIP-1alphaRL-2 (mouse)
Eosinophil eotaxin receptor
CKR3
chemokine (C-C motif) receptor 3
CD193
[ Show all ]
DiseaseAllergic asthma
Allergic rhinitis
Asthma
Length355
Amino acid sequenceMTTSLDTVETFGTTSYYDDVGLLCEKADTRALMAQFVPPLYSLVFTVGLLGNVVVVMILIKYRRLRIMTNIYLLNLAISDLLFLVTLPFWIHYVRGHNWVFGHGMCKLLSGFYHTGLYSEIFFIILLTIDRYLAIVHAVFALRARTVTFGVITSIVTWGLAVLAALPEFIFYETEELFEETLCSALYPEDTVYSWRHFHTLRMTIFCLVLPLLVMAICYTGIIKTLLRCPSKKKYKAIRLIFVIMAVFFIFWTPYNVAILLSSYQSILFGNDCERSKHLDLVMLVTEVIAYSHCCMNPVIYAFVGERFRKYLRHFFHRHLLMHLGRYIPFLPSEKLERTSSVSPSTAEPELSIVF
UniProtP51677
Protein Data BankN/A
GPCR-HGmod modelP51677
3D structure modelThis predicted structure model is from GPCR-EXP P51677.
BioLiPN/A
Therapeutic Target DatabaseT02752, T85228
ChEMBLCHEMBL3473
IUPHAR60
DrugBankN/A

Ligand

NameCHEMBL2088385
Molecular formulaC34H39F3N4O3S
IUPAC nameN-[(1S,2R,4R)-2-[(4-benzylphenyl)sulfonylmethyl]-4-[methyl(propan-2-yl)amino]cyclohexyl]-2-[4-(trifluoromethyl)-1H-benzimidazol-2-yl]acetamide
Molecular weight640.766
Hydrogen bond acceptor8
Hydrogen bond donor2
XlogP6.5
SynonymsBDBM50391020
SCHEMBL3422982
Inchi KeyAYQQJSQHXLZXMR-HFASVGIHSA-N
Inchi IDInChI=1S/C34H39F3N4O3S/c1-22(2)41(3)26-14-17-29(39-32(42)20-31-38-30-11-7-10-28(33(30)40-31)34(35,36)37)25(19-26)21-45(43,44)27-15-12-24(13-16-27)18-23-8-5-4-6-9-23/h4-13,15-16,22,25-26,29H,14,17-21H2,1-3H3,(H,38,40)(H,39,42)/t25-,26+,29-/m0/s1
PubChem CID11456448
ChEMBLCHEMBL2088385
IUPHARN/A
BindingDB50391020
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
Inhibition55.0 %PMID22939233ChEMBL

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