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GPCR

NameC-X-C chemokine receptor type 5
SpeciesHomo sapiens (Human)
GeneCXCR5
SynonymBLR-1
NLR
neurolymphatic receptor
Monocyte-derived receptor 15
MDR15
[ Show all ]
DiseaseSystemic lupus erythematosus
Length372
Amino acid sequenceMNYPLTLEMDLENLEDLFWELDRLDNYNDTSLVENHLCPATEGPLMASFKAVFVPVAYSLIFLLGVIGNVLVLVILERHRQTRSSTETFLFHLAVADLLLVFILPFAVAEGSVGWVLGTFLCKTVIALHKVNFYCSSLLLACIAVDRYLAIVHAVHAYRHRRLLSIHITCGTIWLVGFLLALPEILFAKVSQGHHNNSLPRCTFSQENQAETHAWFTSRFLYHVAGFLLPMLVMGWCYVGVVHRLRQAQRRPQRQKAVRVAILVTSIFFLCWSPYHIVIFLDTLARLKAVDNTCKLNGSLPVAITMCEFLGLAHCCLNPMLYTFAGVKFRSDLSRLLTKLGCTGPASLCQLFPSWRRSSLSESENATSLTTF
UniProtP32302
Protein Data BankN/A
GPCR-HGmod modelP32302
3D structure modelThis predicted structure model is from GPCR-EXP P32302.
BioLiPN/A
Therapeutic Target DatabaseT09528
ChEMBLCHEMBL1075315
IUPHARN/A
DrugBankN/A

Ligand

NameSCHEMBL3312934
Molecular formulaC20H18ClNO4
IUPAC name2-[(3-chloro-2-prop-2-enoxybenzoyl)amino]-1,3-dihydroindene-2-carboxylic acid
Molecular weight371.817
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP3.9
Synonyms2-(2-Allyloxy-3-chloro-benzoylamino)-indan-2-carboxylic acid
KBANFOAVVPTUAL-UHFFFAOYSA-N
CHEMBL3718418
Inchi KeyKBANFOAVVPTUAL-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H18ClNO4/c1-2-10-26-17-15(8-5-9-16(17)21)18(23)22-20(19(24)25)11-13-6-3-4-7-14(13)12-20/h2-9H,1,10-12H2,(H,22,23)(H,24,25)
PubChem CID59314391
ChEMBLCHEMBL3718418
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC503650.0 nMNoneChEMBL

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