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GPCR

NameAdenosine receptor A3
SpeciesHomo sapiens (Human)
GeneADORA3
SynonymARA3
Adenosine receptor A3
A3AR
A3 receptor
TGPCR1
DiseaseCerebrovascular ischaemia
Malaria
Ischemia
Inflammation
Hepatocellular carcinoma; Hepatitis C virus infection
[ Show all ]
Length318
Amino acid sequenceMPNNSTALSLANVTYITMEIFIGLCAIVGNVLVICVVKLNPSLQTTTFYFIVSLALADIAVGVLVMPLAIVVSLGITIHFYSCLFMTCLLLIFTHASIMSLLAIAVDRYLRVKLTVRYKRVTTHRRIWLALGLCWLVSFLVGLTPMFGWNMKLTSEYHRNVTFLSCQFVSVMRMDYMVYFSFLTWIFIPLVVMCAIYLDIFYIIRNKLSLNLSNSKETGAFYGREFKTAKSLFLVLFLFALSWLPLSIINCIIYFNGEVPQLVLYMGILLSHANSMMNPIVYAYKIKKFKETYLLILKACVVCHPSDSLDTSIEKNSE
UniProtP0DMS8
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseT36059
ChEMBLCHEMBL256
IUPHAR21
DrugBankBE0000354

Ligand

NameCHEMBL1766351
Molecular formulaC21H15ClN4O2
IUPAC name1-(2-chlorophenyl)-3-(4-oxo-3-phenylphthalazin-1-yl)urea
Molecular weight390.827
Hydrogen bond acceptor3
Hydrogen bond donor2
XlogP4.1
SynonymsN/A
Inchi KeyAGLMEUZMKJWGHN-UHFFFAOYSA-N
Inchi IDInChI=1S/C21H15ClN4O2/c22-17-12-6-7-13-18(17)23-21(28)24-19-15-10-4-5-11-16(15)20(27)26(25-19)14-8-2-1-3-9-14/h1-13H,(H2,23,24,25,28)
PubChem CID52937927
ChEMBLCHEMBL1766351
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
Inhibition49.0 %PMID21401121ChEMBL

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