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GPCR

NameC-C chemokine receptor type 7
SpeciesHomo sapiens (Human)
GeneCCR7
SynonymMIP-3 beta receptor
Epstein-Barr virus-induced G-protein coupled receptor 1
EBV-induced G-protein coupled receptor 1
EBI1
EBI-1
[ Show all ]
DiseaseN/A
Length378
Amino acid sequenceMDLGKPMKSVLVVALLVIFQVCLCQDEVTDDYIGDNTTVDYTLFESLCSKKDVRNFKAWFLPIMYSIICFVGLLGNGLVVLTYIYFKRLKTMTDTYLLNLAVADILFLLTLPFWAYSAAKSWVFGVHFCKLIFAIYKMSFFSGMLLLLCISIDRYVAIVQAVSAHRHRARVLLISKLSCVGIWILATVLSIPELLYSDLQRSSSEQAMRCSLITEHVEAFITIQVAQMVIGFLVPLLAMSFCYLVIIRTLLQARNFERNKAIKVIIAVVVVFIVFQLPYNGVVLAQTVANFNITSSTCELSKQLNIAYDVTYSLACVRCCVNPFLYAFIGVKFRNDLFKLFKDLGCLSQEQLRQWSSCRHIRRSSMSVEAETTTTFSP
UniProtP32248
Protein Data BankN/A
GPCR-HGmod modelP32248
3D structure modelThis predicted structure model is from GPCR-EXP P32248.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4594
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL2435856
Molecular formulaC34H40N4O5
IUPAC name4-[6-ethyl-5-[[4-[(5R)-3-(oxan-4-yl)-2-oxo-5-phenylimidazolidin-1-yl]piperidin-1-yl]methyl]pyridin-2-yl]oxybenzoic acid
Molecular weight584.717
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.4
SynonymsBDBM50441713
SCHEMBL5576709
4-[[6-Ethyl-5-[[4-[(5R)-2-oxo-5-phenyl-3-(tetrahydro-2H-pyran-4-yl)imidazolidine-1-yl]piperidino]methyl]pyridine-2-yl]oxy]benzoic acid
Inchi KeyFJAGYOZYOQUDEQ-HKBQPEDESA-N
Inchi IDInChI=1S/C34H40N4O5/c1-2-30-26(10-13-32(35-30)43-29-11-8-25(9-12-29)33(39)40)22-36-18-14-28(15-19-36)38-31(24-6-4-3-5-7-24)23-37(34(38)41)27-16-20-42-21-17-27/h3-13,27-28,31H,2,14-23H2,1H3,(H,39,40)/t31-/m0/s1
PubChem CID58835217
ChEMBLCHEMBL2435856
IUPHARN/A
BindingDB50441713
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Inhibition93.6 %PMID24090135ChEMBL

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