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GPCR

NameC-X-C chemokine receptor type 1
SpeciesHomo sapiens (Human)
GeneCXCR1
SynonymCDw128a
IL8RA
IL-8R A
IL-8 receptor type I
IL-8 receptor type 1
[ Show all ]
DiseaseN/A
Length350
Amino acid sequenceMSNITDPQMWDFDDLNFTGMPPADEDYSPCMLETETLNKYVVIIAYALVFLLSLLGNSLVMLVILYSRVGRSVTDVYLLNLALADLLFALTLPIWAASKVNGWIFGTFLCKVVSLLKEVNFYSGILLLACISVDRYLAIVHATRTLTQKRHLVKFVCLGCWGLSMNLSLPFFLFRQAYHPNNSSPVCYEVLGNDTAKWRMVLRILPHTFGFIVPLFVMLFCYGFTLRTLFKAHMGQKHRAMRVIFAVVLIFLLCWLPYNLVLLADTLMRTQVIQESCERRNNIGRALDATEILGFLHSCLNPIIYAFIGQNFRHGFLKILAMHGLVSKEFLARHRVTSYTSSSVNVSSNL
UniProtP25024
Protein Data BankN/A
GPCR-HGmod modelP25024
3D structure modelThis predicted structure model is from GPCR-EXP P25024.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4029
IUPHAR68
DrugBankBE0003552

Ligand

NameCHEMBL361312
Molecular formulaC20H21ClN2O2
IUPAC name3-[4-[3-(4-chlorophenyl)-1,2-oxazol-5-yl]phenoxy]-N,N-dimethylpropan-1-amine
Molecular weight356.85
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.7
Synonyms(3-{4-[3-(4-Chloro-phenyl)-isoxazol-5-yl]-phenoxy}-propyl)-dimethyl-amine
BDBM50150569
Inchi KeyCHQJWHNOXDJENO-UHFFFAOYSA-N
Inchi IDInChI=1S/C20H21ClN2O2/c1-23(2)12-3-13-24-18-10-6-16(7-11-18)20-14-19(22-25-20)15-4-8-17(21)9-5-15/h4-11,14H,3,12-13H2,1-2H3
PubChem CID10291817
ChEMBLCHEMBL361312
IUPHARN/A
BindingDB50150569
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC503900.0 nMPMID15261292BindingDB,ChEMBL

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