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GPCR

NameC3a anaphylatoxin chemotactic receptor
SpeciesHomo sapiens (Human)
GeneC3AR1
SynonymC3a anaphylatoxin chemotactic receptor
C3a receptor
C3AR
anaphylatoxin C3a receptor
complement component 3a receptor 1
[ Show all ]
DiseaseN/A
Length482
Amino acid sequenceMASFSAETNSTDLLSQPWNEPPVILSMVILSLTFLLGLPGNGLVLWVAGLKMQRTVNTIWFLHLTLADLLCCLSLPFSLAHLALQGQWPYGRFLCKLIPSIIVLNMFASVFLLTAISLDRCLVVFKPIWCQNHRNVGMACSICGCIWVVAFVMCIPVFVYREIFTTDNHNRCGYKFGLSSSLDYPDFYGDPLENRSLENIVQPPGEMNDRLDPSSFQTNDHPWTVPTVFQPQTFQRPSADSLPRGSARLTSQNLYSNVFKPADVVSPKIPSGFPIEDHETSPLDNSDAFLSTHLKLFPSASSNSFYESELPQGFQDYYNLGQFTDDDQVPTPLVAITITRLVVGFLLPSVIMIACYSFIVFRMQRGRFAKSQSKTFRVAVVVVAVFLVCWTPYHIFGVLSLLTDPETPLGKTLMSWDHVCIALASANSCFNPFLYALLGKDFRKKARQSIQGILEAAFSEELTRSTHCPSNNVISERNSTTV
UniProtQ16581
Protein Data BankN/A
GPCR-HGmod modelQ16581
3D structure modelThis predicted structure model is from GPCR-EXP Q16581.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4761
IUPHAR31
DrugBankN/A

Ligand

NameCHEMBL96477
Molecular formulaC19H20ClN3
IUPAC name3-N-[2-(4-chlorophenyl)ethyl]-1-N-propan-2-ylisoindole-1,3-diimine
Molecular weight325.84
Hydrogen bond acceptor2
Hydrogen bond donor1
XlogP4.3
SynonymsBDBM50105656
N-Isopropyl-N'-(4-chlorophenethyl)isoindoline-1,3-diimine
1-[(Z)-2-(4-Chloro-phenyl)-ethylimino]-3-[(Z)-isopropylimino]-2,3-dihydro-1H-isoindole
Inchi KeyGNARPECAOHHEJG-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H20ClN3/c1-13(2)22-19-17-6-4-3-5-16(17)18(23-19)21-12-11-14-7-9-15(20)10-8-14/h3-10,13H,11-12H2,1-2H3,(H,21,22,23)
PubChem CID136110888
ChEMBLCHEMBL96477
IUPHARN/A
BindingDB50105656
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC508450.0 nMPMID11597407ChEMBL
IC508450.0 nMPMID11597407BindingDB

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