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GPCR

NameG-protein coupled receptor 84
SpeciesHomo sapiens (Human)
GeneGPR84
SynonymGPCR4
GPR84
Inflammation-related G-protein coupled receptor EX33
DiseaseN/A
Length396
Amino acid sequenceMWNSSDANFSCYHESVLGYRYVAVSWGVVVAVTGTVGNVLTLLALAIQPKLRTRFNLLIANLTLADLLYCTLLQPFSVDTYLHLHWRTGATFCRVFGLLLFASNSVSILTLCLIALGRYLLIAHPKLFPQVFSAKGIVLALVSTWVVGVASFAPLWPIYILVPVVCTCSFDRIRGRPYTTILMGIYFVLGLSSVGIFYCLIHRQVKRAAQALDQYKLRQASIHSNHVARTDEAMPGRFQELDSRLASGGPSEGISSEPVSAATTQTLEGDSSEVGDQINSKRAKQMAEKSPPEASAKAQPIKGARRAPDSSSEFGKVTRMCFAVFLCFALSYIPFLLLNILDARVQAPRVVHMLAANLTWLNGCINPVLYAAMNRQFRQAYGSILKRGPRSFHRLH
UniProtQ9NQS5
Protein Data BankN/A
GPCR-HGmod modelQ9NQS5
3D structure modelThis predicted structure model is from GPCR-EXP Q9NQS5.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3714079
IUPHAR120
DrugBankN/A

Ligand

NameCHEMBL3717979
Molecular formulaC26H26N4O6
IUPAC name2-(2,3-dihydro-[1,4]dioxino[2,3-b]pyridin-2-ylmethoxy)-N-(oxan-4-yl)-4-oxo-6,7-dihydropyrimido[6,1-a]isoquinoline-9-carboxamide
Molecular weight490.516
Hydrogen bond acceptor7
Hydrogen bond donor1
XlogP2.0
SynonymsSCHEMBL15839450
Inchi KeyDDSYRKBWRSZSLA-UHFFFAOYSA-N
Inchi IDInChI=1S/C26H26N4O6/c31-24(28-18-6-10-33-11-7-18)17-3-4-20-16(12-17)5-9-30-21(20)13-23(29-26(30)32)34-14-19-15-35-25-22(36-19)2-1-8-27-25/h1-4,8,12-13,18-19H,5-7,9-11,14-15H2,(H,28,31)
PubChem CID90253148
ChEMBLCHEMBL3717979
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
IC50100.0 nMNoneChEMBL

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