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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

NameCHEMBL37566
Molecular formulaC25H23Cl2N3O3
IUPAC name2-(2,6-dichlorophenyl)-2-[4-[(7-methyl-2-propylimidazo[4,5-b]pyridin-3-yl)methyl]phenoxy]acetic acid
Molecular weight484.377
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP6.4
SynonymsBDBM50285353
(2,6-Dichloro-phenyl)-[4-(7-methyl-2-propyl-imidazo[4,5-b]pyridin-3-ylmethyl)-phenoxy]-acetic acid
Inchi KeyAJGGEXGEYWLKKM-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H23Cl2N3O3/c1-3-5-20-29-22-15(2)12-13-28-24(22)30(20)14-16-8-10-17(11-9-16)33-23(25(31)32)21-18(26)6-4-7-19(21)27/h4,6-13,23H,3,5,14H2,1-2H3,(H,31,32)
PubChem CID15287886
ChEMBLCHEMBL37566
IUPHARN/A
BindingDB50285353
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC5021.0 nM, Bioorg. Med. Chem. Lett., (1995) 5:2:155BindingDB,ChEMBL

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