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GPCR

NameAdenosine receptor A1
SpeciesRattus norvegicus (Rat)
GeneAdora1
SynonymA1 receptor
A1-AR
A1R
adenosine receptor A1
RDC7
DiseaseN/A for non-human GPCRs
Length326
Amino acid sequenceMPPYISAFQAAYIGIEVLIALVSVPGNVLVIWAVKVNQALRDATFCFIVSLAVADVAVGALVIPLAILINIGPQTYFHTCLMVACPVLILTQSSILALLAIAVDRYLRVKIPLRYKTVVTQRRAAVAIAGCWILSLVVGLTPMFGWNNLSVVEQDWRANGSVGEPVIKCEFEKVISMEYMVYFNFFVWVLPPLLLMVLIYLEVFYLIRKQLNKKVSASSGDPQKYYGKELKIAKSLALILFLFALSWLPLHILNCITLFCPTCQKPSILIYIAIFLTHGNSAMNPIVYAFRIHKFRVTFLKIWNDHFRCQPKPPIDEDLPEEKAED
UniProtP25099
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL318
IUPHAR18
DrugBankN/A

Ligand

NameCHEMBL303883
Molecular formulaC15H17N5
IUPAC name1-ethyl-4-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinoxaline
Molecular weight267.336
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP3.3
Synonyms1-ethyl-4-(pyrrolidin-1-yl)[1,2,4]triazolo[4,3-a]quinoxaline
MCULE-4697289646
1-Ethyl-4-pyrrolidin-1-yl-[1,2,4]triazolo[4,3-a]quinoxaline
STK919052
AKOS000482765
[ Show all ]
Inchi KeyAPJHYJWRJHOAHR-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H17N5/c1-2-13-17-18-15-14(19-9-5-6-10-19)16-11-7-3-4-8-12(11)20(13)15/h3-4,7-8H,2,5-6,9-10H2,1H3
PubChem CID14783686
ChEMBLCHEMBL303883
IUPHARN/A
BindingDB50015826
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC5010000.0 nMPMID2374150BindingDB,ChEMBL

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