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GPCR

NameType-1A angiotensin II receptor
SpeciesRattus norvegicus (Rat)
GeneAgtr1
SynonymAngiotensin II type-1A receptor
AT1A
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMALNSSAEDGIKRIQDDCPKAGRHSYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIHRNVYFIENTNITVCAFHYESRNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCKISDIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSSLSTKMSTLSYRPSDNMSSSAKKPASCFEVE
UniProtP25095
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL329
IUPHAR34
DrugBankN/A

Ligand

NameCHEMBL2260194
Molecular formulaC31H26N4O2
IUPAC namemethyl 4-[4-[[2-methyl-6-(1-methylbenzimidazol-2-yl)benzimidazol-1-yl]methyl]phenyl]benzoate
Molecular weight486.575
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP6.1
SynonymsN/A
Inchi KeyCXBBAULOELQRLR-UHFFFAOYSA-N
Inchi IDInChI=1S/C31H26N4O2/c1-20-32-27-17-16-25(30-33-26-6-4-5-7-28(26)34(30)2)18-29(27)35(20)19-21-8-10-22(11-9-21)23-12-14-24(15-13-23)31(36)37-3/h4-18H,19H2,1-3H3
PubChem CID76326458
ChEMBLCHEMBL2260194
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
Inhibition40.0 %Med Chem Res, (2009) 18:8:611ChEMBL
Ki<10000.0 nMMed Chem Res, (2009) 18:8:611ChEMBL

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