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GPCR

NameG-protein coupled receptor 183
SpeciesHomo sapiens (Human)
GeneGPR183
SynonymEBI2 {ECO:0000303|PubMed:8383238}
lymphocyte-specific G protein-coupled receptor
hEBI2 {ECO:0000303|PubMed:22875855}
GPR183
G protein-coupled receptor 183
[ Show all ]
DiseaseN/A
Length361
Amino acid sequenceMDIQMANNFTPPSATPQGNDCDLYAHHSTARIVMPLHYSLVFIIGLVGNLLALVVIVQNRKKINSTTLYSTNLVISDILFTTALPTRIAYYAMGFDWRIGDALCRITALVFYINTYAGVNFMTCLSIDRFIAVVHPLRYNKIKRIEHAKGVCIFVWILVFAQTLPLLINPMSKQEAERITCMEYPNFEETKSLPWILLGACFIGYVLPLIIILICYSQICCKLFRTAKQNPLTEKSGVNKKALNTIILIIVVFVLCFTPYHVAIIQHMIKKLRFSNFLECSQRHSFQISLHFTVCLMNFNCCMDPFIYFFACKGYKRKVMRMLKRQVSVSISSAVKSAPEENSREMTETQMMIHSKSSNGK
UniProtP32249
Protein Data BankN/A
GPCR-HGmod modelP32249
3D structure modelThis predicted structure model is from GPCR-EXP P32249.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3259470
IUPHAR81
DrugBankN/A

Ligand

NameNIBR189
Molecular formulaC21H21BrN2O3
IUPAC name(E)-3-(4-bromophenyl)-1-[4-(4-methoxybenzoyl)piperazin-1-yl]prop-2-en-1-one
Molecular weight429.314
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP3.4
Synonyms(E)-3-(4-Bromophenyl)-1-(4-(4-methoxybenzoyl)piperazin-1-yl)prop-2-en-1-one
BDBM50011716
MolPort-009-629-631
ZINC29118586
2896AH
[ Show all ]
Inchi KeyOFHXXBRBGWUOHR-NYYWCZLTSA-N
Inchi IDInChI=1S/C21H21BrN2O3/c1-27-19-9-5-17(6-10-19)21(26)24-14-12-23(13-15-24)20(25)11-4-16-2-7-18(22)8-3-16/h2-11H,12-15H2,1H3/b11-4+
PubChem CID36295259
ChEMBLCHEMBL3262896
IUPHARN/A
BindingDB50011716
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC500.2239 nMPMID24678947ChEMBL
IC500.3 nMPMID24678947ChEMBL
IC500.3 nMPMID24678947BindingDB
IC500.564 nMPubChem BioAssay data setChEMBL
IC507.0 nMPMID24678947BindingDB
IC507.0 nMPMID24678947ChEMBL
IC507.079 nMPMID24678947ChEMBL
IC508.5 nMPMID24678947BindingDB,ChEMBL
IC508.511 nMPMID24678947ChEMBL
IC508.71 nMPMID24678947ChEMBL
IC509.0 nMPMID24678947ChEMBL
IC509.0 nMPMID24678947BindingDB
IC5010.0 nMPMID24678947BindingDB
IC5010.47 nMPMID24678947ChEMBL
IC5011.0 nMPMID24678947ChEMBL

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