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GPCR

NameType-2 angiotensin II receptor
SpeciesHomo sapiens (Human)
GeneAGTR2
SynonymAT2
MRX88
Agtr2
angiotensin II receptor
angiotensin II receptor, type 2
[ Show all ]
DiseasePostherpetic neuralgia
Hypertension
Length363
Amino acid sequenceMKGNSTLATTSKNITSGLHFGLVNISGNNESTLNCSQKPSDKHLDAIPILYYIIFVIGFLVNIVVVTLFCCQKGPKKVSSIYIFNLAVADLLLLATLPLWATYYSYRYDWLFGPVMCKVFGSFLTLNMFASIFFITCMSVDRYQSVIYPFLSQRRNPWQASYIVPLVWCMACLSSLPTFYFRDVRTIEYLGVNACIMAFPPEKYAQWSAGIALMKNILGFIIPLIFIATCYFGIRKHLLKTNSYGKNRITRDQVLKMAAAVVLAFIICWLPFHVLTFLDALAWMGVINSCEVIAVIDLALPFAILLGFTNSCVNPFLYCFVGNRFQQKLRSVFRVPITWLQGKRESMSCRKSSSLREMETFVS
UniProtP50052
Protein Data Bank5xjm, 5unh, 5ung, 5unf
GPCR-HGmod modelP50052
3D structure modelThis structure is from PDB ID 5xjm.
BioLiPBL0419199, BL0375199,BL0375200, BL0375198, BL0375196,BL0375197
Therapeutic Target DatabaseT09909
ChEMBLCHEMBL4607
IUPHAR35
DrugBankBE0003426

Ligand

NameCHEMBL3105387
Molecular formulaC17H22N4O3
IUPAC nameN-[(2S,3S)-1-(hydroxyamino)-3-methyl-1-oxopentan-2-yl]-3-(imidazol-1-ylmethyl)benzamide
Molecular weight330.388
Hydrogen bond acceptor4
Hydrogen bond donor3
XlogP1.5
SynonymsN/A
Inchi KeyCBSXTIPWBNLDKI-WFASDCNBSA-N
Inchi IDInChI=1S/C17H22N4O3/c1-3-12(2)15(17(23)20-24)19-16(22)14-6-4-5-13(9-14)10-21-8-7-18-11-21/h4-9,11-12,15,24H,3,10H2,1-2H3,(H,19,22)(H,20,23)/t12-,15-/m0/s1
PubChem CID73213095
ChEMBLCHEMBL3105387
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Inhibition4.0 %PMID24388688ChEMBL

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