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GPCR

NameC-X-C chemokine receptor type 2
SpeciesHomo sapiens (Human)
GeneCXCR2
Synonymchemokine (C-X-C motif) receptor 2
KC receptor
CD128
IL8RB
IL-8R2
[ Show all ]
DiseaseCystic fibrosis; Chronic obstructive pulmonary disease
Asthma
Cancer
Ischemia-reperfusion injury; Lung transplantation; Graft rejection in heart transplantation
Fungal infections
[ Show all ]
Length360
Amino acid sequenceMEDFNMESDSFEDFWKGEDLSNYSYSSTLPPFLLDAAPCEPESLEINKYFVVIIYALVFLLSLLGNSLVMLVILYSRVGRSVTDVYLLNLALADLLFALTLPIWAASKVNGWIFGTFLCKVVSLLKEVNFYSGILLLACISVDRYLAIVHATRTLTQKRYLVKFICLSIWGLSLLLALPVLLFRRTVYSSNVSPACYEDMGNNTANWRMLLRILPQSFGFIVPLLIMLFCYGFTLRTLFKAHMGQKHRAMRVIFAVVLIFLLCWLPYNLVLLADTLMRTQVIQETCERRNHIDRALDATEILGILHSCLNPLIYAFIGQKFRHGLLKILAIHGLISKDSLPKDSRPSFVGSSSGHTSTTL
UniProtP25025
Protein Data BankN/A
GPCR-HGmod modelP25025
3D structure modelThis predicted structure model is from GPCR-EXP P25025.
BioLiPN/A
Therapeutic Target DatabaseT56923
ChEMBLCHEMBL2434
IUPHAR69
DrugBankN/A

Ligand

NameCHEMBL3658331
Molecular formulaC25H17F4N3O2S2
IUPAC nameN-(4-fluorophenyl)-6-[2-[4-methyl-2-[4-(trifluoromethyl)phenyl]-1,3-thiazol-5-yl]-2-oxoethyl]sulfanylpyridine-3-carboxamide
Molecular weight531.544
Hydrogen bond acceptor10
Hydrogen bond donor1
XlogP6.4
SynonymsBDBM150959
US8981106, 148
Inchi KeyBDDODTYDGUNSBW-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H17F4N3O2S2/c1-14-22(36-24(31-14)15-2-5-17(6-3-15)25(27,28)29)20(33)13-35-21-11-4-16(12-30-21)23(34)32-19-9-7-18(26)8-10-19/h2-12H,13H2,1H3,(H,32,34)
PubChem CID91937324
ChEMBLCHEMBL3658331
IUPHARN/A
BindingDB150959
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
IC50<5000.0 nM, NoneBindingDB,ChEMBL

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