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GPCR

NameProbable C-C chemokine receptor type 3
SpeciesMus musculus (Mouse)
GeneCcr3
SynonymCC-CKR-3
MIP-1alphaRL-2 (mouse)
MIP-1 alpha RL2
Macrophage inflammatory protein 1-alpha receptor-like 2
CKR3
[ Show all ]
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMAFNTDEIKTVVESFETTPYEYEWAPPCEKVRIKELGSWLLPPLYSLVFIIGLLGNMMVVLILIKYRKLQIMTNIYLFNLAISDLLFLFTVPFWIHYVLWNEWGFGHYMCKMLSGFYYLALYSEIFFIILLTIDRYLAIVHAVFALRARTVTFATITSIITWGLAGLAALPEFIFHESQDSFGEFSCSPRYPEGEEDSWKRFHALRMNIFGLALPLLIMVICYSGIIKTLLRCPNKKKHKAIRLIFVVMIVFFIFWTPYNLVLLFSAFHSTFLETSCQQSKHLDLAMQVTEVIAYTHCCINPVIYAFVGERFRKHLRLFFHRNVAVYLGKYIPFLPGEKMERTSSVSPSTGEQEISVVF
UniProtP51678
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3406
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL3355951
Molecular formulaC30H32F2N2S
IUPAC name2-ethyl-6-fluoro-3-[1-[3-(4-fluorophenyl)sulfanylpropyl]piperidin-4-yl]-1-phenylindole
Molecular weight490.657
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP7.8
SynonymsBDBM50041190
SCHEMBL2564463
2-ETHYL-6-FLUORO-3-{1-[3-(4-FLUOROPHENYLSULFANYL)-PROPYL]-PIPERIDIN-4-YL}-1-PHENYL-1H-INDOLE
YWGYONXMCGHURW-UHFFFAOYSA-N
Inchi KeyYWGYONXMCGHURW-UHFFFAOYSA-N
Inchi IDInChI=1S/C30H32F2N2S/c1-2-28-30(27-14-11-24(32)21-29(27)34(28)25-7-4-3-5-8-25)22-15-18-33(19-16-22)17-6-20-35-26-12-9-23(31)10-13-26/h3-5,7-14,21-22H,2,6,15-20H2,1H3
PubChem CID11952524
ChEMBLCHEMBL3355951
IUPHARN/A
BindingDB50041190
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki650.0 nMPMID25497216BindingDB,ChEMBL

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