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GPCR

NameType-1B angiotensin II receptor
SpeciesRattus norvegicus (Rat)
GeneAgtr1b
SynonymAngiotensin II type-1B receptor
AT1B
AT3
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMTLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLVVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNHLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLMAGLASLPAVIYRNVYFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFVFPFLIILTSYTLIWKALKKAYKIQKNTPRNDDIFRIIMAIVLFFFFSWVPHQIFTFLDVLIQLGIIRDCEIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPTAKSHAGLSTKMSTLSYRPSDNMSSSAKKSASFFEVE
UniProtP29089
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL263
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL309384
Molecular formulaC23H22N8
IUPAC name5-methyl-7-propyl-8-[[4-[2-(2H-tetrazol-5-yl)phenyl]phenyl]methyl]-[1,2,4]triazolo[1,5-c]pyrimidine
Molecular weight410.485
Hydrogen bond acceptor6
Hydrogen bond donor1
XlogP4.4
SynonymsSCHEMBL9309186
5-Methyl-7-propyl-8-[2''-(1H-tetrazol-5-yl)-biphenyl-4-ylmethyl]-[1,2,4]triazolo[1,5-c]pyrimidine
BDBM50039374
L008075
5-Methyl-7-propyl-8-[[2'-(1H-tetrazol-5-yl)-1,1'-biphenyl-4-yl]methyl][1,2,4]triazolo[1,5-c]pyrimidine
Inchi KeyFWZKQZUEJPQQDN-UHFFFAOYSA-N
Inchi IDInChI=1S/C23H22N8/c1-3-6-21-20(23-24-14-25-31(23)15(2)26-21)13-16-9-11-17(12-10-16)18-7-4-5-8-19(18)22-27-29-30-28-22/h4-5,7-12,14H,3,6,13H2,1-2H3,(H,27,28,29,30)
PubChem CID10001600
ChEMBLCHEMBL309384
IUPHARN/A
BindingDB50039374
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki12.0 nMPMID8057285BindingDB,ChEMBL

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