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GPCR

NameBeta-1 adrenergic receptor
SpeciesRattus norvegicus (Rat)
GeneAdrb1
Synonymadrenergic receptor
beta1-adrenoceptor
Beta-1 adrenoreceptor
Beta-1 adrenoceptor
beta-1 adrenergic receptor
[ Show all ]
DiseaseN/A for non-human GPCRs
Length466
Amino acid sequenceMGAGALALGASEPCNLSSAAPLPDGAATAARLLVLASPPASLLPPASEGSAPLSQQWTAGMGLLLALIVLLIVVGNVLVIVAIAKTPRLQTLTNLFIMSLASADLVMGLLVVPFGATIVVWGRWEYGSFFCELWTSVDVLCVTASIETLCVIALDRYLAITLPFRYQSLLTRARARALVCTVWAISALVSFLPILMHWWRAESDEARRCYNDPKCCDFVTNRAYAIASSVVSFYVPLCIMAFVYLRVFREAQKQVKKIDSCERRFLTGPPRPPSPAPSPSPGPPRPADSLANGRSSKRRPSRLVALREQKALKTLGIIMGVFTLCWLPFFLANVVKAFHRDLVPDRLFVFFNWLGYANSAFNPIIYCRSPDFRKAFQRLLCCARRAACRRRAAHGDRPRASGCLARAGPPPSPGAPSDDDDDDAGATPPARLLEPWAGCNGGTTTVDSDSSLDEPGRQGFSSESKV
UniProtP18090
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3252
IUPHARN/A
DrugBankN/A

Ligand

Nameisoproterenol
Molecular formulaC11H17NO3
IUPAC name4-[1-hydroxy-2-(propan-2-ylamino)ethyl]benzene-1,2-diol
Molecular weight211.261
Hydrogen bond acceptor4
Hydrogen bond donor4
XlogP-0.6
SynonymsMedihaler-ISO
NCGC00015558-07
NCGC00025274-03
NSC 33791
PDSP2_001409
[ Show all ]
Inchi KeyJWZZKOKVBUJMES-UHFFFAOYSA-N
Inchi IDInChI=1S/C11H17NO3/c1-7(2)12-6-11(15)8-3-4-9(13)10(14)5-8/h3-5,7,11-15H,6H2,1-2H3
PubChem CID3779
ChEMBLCHEMBL434
IUPHAR536
BindingDB25392
DrugBankDB01064

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
-Log EC209.82 -PMID11311067ChEMBL
EC200.15 nMPMID12502364ChEMBL
Efficacy1.0 -PMID2999409ChEMBL
IC505.3 nMPMID1354264BindingDB,ChEMBL
IC50600.0 nMPMID1354264BindingDB,ChEMBL
Ki80.0 nMPMID8230093, PMID1313109BindingDB,ChEMBL
Ki670.0 nMPMID1672155BindingDB
Ki670.0 nMPMID1672155ChEMBL
Km32000.0 nMPMID2999409ChEMBL
pEC209.82 -PMID12502364ChEMBL

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