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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

NameCHEMBL3735468
Molecular formulaC15H12ClN3O
IUPAC name4-(4-chlorophenyl)-6-(5-methylfuran-2-yl)pyrimidin-2-amine
Molecular weight285.731
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP3.3
SynonymsN/A
Inchi KeyAAFPITMZIGAOIF-UHFFFAOYSA-N
Inchi IDInChI=1S/C15H12ClN3O/c1-9-2-7-14(20-9)13-8-12(18-15(17)19-13)10-3-5-11(16)6-4-10/h2-8H,1H3,(H2,17,18,19)
PubChem CID75360148
ChEMBLCHEMBL3735468
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
Ki434.0 nMPMID26462195ChEMBL

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