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GPCR

NameType-1 angiotensin II receptor
SpeciesHomo sapiens (Human)
GeneAGTR1
SynonymType-1 angiotensin II receptor
HAT1R
Agtr-1a
type-1A angiotensin II receptor
AT1
[ Show all ]
DiseaseMetabolic syndrome x
Myocardial infarction
Hypertension
Restenosis
Alzheimer disease
[ Show all ]
Length359
Amino acid sequenceMILNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWIPHQIFTFLDVLIQLGIIRDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKRYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSTKKPAPCFEVE
UniProtP30556
Protein Data Bank6do1, 4zud, 4yay
GPCR-HGmod modelP30556
3D structure modelThis structure is from PDB ID 6do1.
BioLiPBL0312790, BL0326733, BL0439004,BL0439005
Therapeutic Target DatabaseT74456
ChEMBLCHEMBL227
IUPHAR34
DrugBankBE0000062

Ligand

NameCHEMBL2337677
Molecular formulaC36H35BrN10O
IUPAC name[4-butyl-1,3-bis[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]imidazol-1-ium-2-yl]methanol;bromide
Molecular weight703.649
Hydrogen bond acceptor8
Hydrogen bond donor3
XlogPNone
SynonymsN/A
Inchi KeyBQSGXNWTTKZZRO-UHFFFAOYSA-M
Inchi IDInChI=1S/C36H35N10O.BrH/c1-2-3-8-29-23-45(21-25-13-17-27(18-14-25)30-9-4-6-11-32(30)35-37-41-42-38-35)34(24-47)46(29)22-26-15-19-28(20-16-26)31-10-5-7-12-33(31)36-39-43-44-40-36;/h4-7,9-20,23,47H,2-3,8,21-22,24H2,1H3,(H,37,38,41,42)(H,39,40,43,44);1H/q+1;/p-1
PubChem CID71652857
ChEMBLCHEMBL2337677
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
Partition coefficient log P of this ligand is not available.

Experimental Data

ParameterValueReferenceDatabase source
IC504.266 nMPMID23376252ChEMBL

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