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GPCR

NameType-1 angiotensin II receptor
SpeciesOryctolagus cuniculus (Rabbit)
GeneAGTR1
SynonymAngiotensin II type-1 receptor
AT1
DiseaseN/A for non-human GPCRs
Length359
Amino acid sequenceMMLNSSTEDGIKRIQDDCPKAGRHNYIFVMIPTLYSIIFVVGIFGNSLAVIVIYFYMKLKTVASVFLLNLALADLCFLLTLPLWAVYTAMEYRWPFGNYLCKIASASVSFNLYASVFLLTCLSIDRYLAIVHPMKSRLRRTMLVAKVTCIIIWLLAGLASLPAIIHRNVFFIENTNITVCAFHYESQNSTLPIGLGLTKNILGFLFPFLIILTSYTLIWKALKKAYEIQKNKPRNDDIFKIIMAIVLFFFFSWVPHQIFTFLDVLIQLGVIHDCRIADIVDTAMPITICIAYFNNCLNPLFYGFLGKKFKKYFLQLLKYIPPKAKSHSNLSTKMSTLSYRPSDNVSSSSKKPVPCFEVE
UniProtP34976
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3948
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL136034
Molecular formulaC27H29ClN4O2
IUPAC name2-(2-chlorophenyl)-2-[N-ethyl-4-[(2-ethyl-5,7-dimethylimidazo[4,5-b]pyridin-3-yl)methyl]anilino]acetic acid
Molecular weight477.005
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.3
Synonyms(2-Chloro-phenyl)-{ethyl-[4-(2-ethyl-5,7-dimethyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenyl]-amino}-acetic acid
BDBM50043458
Inchi KeyCQVZPQFZYLIETQ-UHFFFAOYSA-N
Inchi IDInChI=1S/C27H29ClN4O2/c1-5-23-30-24-17(3)15-18(4)29-26(24)32(23)16-19-11-13-20(14-12-19)31(6-2)25(27(33)34)21-9-7-8-10-22(21)28/h7-15,25H,5-6,16H2,1-4H3,(H,33,34)
PubChem CID9982458
ChEMBLCHEMBL136034
IUPHARN/A
BindingDB50043458
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50380.0 nMPMID8277506BindingDB,ChEMBL

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