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GPCR

NameC-X-C chemokine receptor type 3
SpeciesMus musculus (Mouse)
GeneCxcr3
SynonymIP-10 receptor
Interferon-inducible protein 10 receptor
GPR9
G protein-coupled receptor 9
CXCR3
[ Show all ]
DiseaseN/A for non-human GPCRs
Length367
Amino acid sequenceMYLEVSERQVLDASDFAFLLENSTSPYDYGENESDFSDSPPCPQDFSLNFDRTFLPALYSLLFLLGLLGNGAVAAVLLSQRTALSSTDTFLLHLAVADVLLVLTLPLWAVDAAVQWVFGPGLCKVAGALFNINFYAGAFLLACISFDRYLSIVHATQIYRRDPRVRVALTCIVVWGLCLLFALPDFIYLSANYDQRLNATHCQYNFPQVGRTALRVLQLVAGFLLPLLVMAYCYAHILAVLLVSRGQRRFRAMRLVVVVVAAFAVCWTPYHLVVLVDILMDVGVLARNCGRESHVDVAKSVTSGMGYMHCCLNPLLYAFVGVKFREQMWMLFTRLGRSDQRGPQRQPSSSRRESSWSETTEASYLGL
UniProtO88410
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL5200
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL1808997
Molecular formulaC28H32N4O4
IUPAC name(6aR,9R)-9-N,9-N-bis(2-methoxyethyl)-7-N-phenyl-6,6a,8,9-tetrahydro-4H-indolo[4,3-fg]quinoline-7,9-dicarboxamide
Molecular weight488.588
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP2.0
SynonymsBDBM50349639
Inchi KeyZWQFKHFUOPFJAH-CJFMBICVSA-N
Inchi IDInChI=1S/C28H32N4O4/c1-35-13-11-31(12-14-36-2)27(33)20-15-23-22-9-6-10-24-26(22)19(17-29-24)16-25(23)32(18-20)28(34)30-21-7-4-3-5-8-21/h3-10,15,17,20,25,29H,11-14,16,18H2,1-2H3,(H,30,34)/t20-,25-/m1/s1
PubChem CID56660098
ChEMBLCHEMBL1808997
IUPHARN/A
BindingDB50349639
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50437.0 nMPMID21764306BindingDB,ChEMBL

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