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GPCR

NameApelin receptor
SpeciesHomo sapiens (Human)
GeneAPLNR
Synonymmsr/apj
GPCR34
G-protein coupled receptor HG11
G-protein coupled receptor APJ
AGTRL1
[ Show all ]
DiseaseN/A
Length380
Amino acid sequenceMEEGGDFDNYYGADNQSECEYTDWKSSGALIPAIYMLVFLLGTTGNGLVLWTVFRSSREKRRSADIFIASLAVADLTFVVTLPLWATYTYRDYDWPFGTFFCKLSSYLIFVNMYASVFCLTGLSFDRYLAIVRPVANARLRLRVSGAVATAVLWVLAALLAMPVMVLRTTGDLENTTKVQCYMDYSMVATVSSEWAWEVGLGVSSTTVGFVVPFTIMLTCYFFIAQTIAGHFRKERIEGLRKRRRLLSIIVVLVVTFALCWMPYHLVKTLYMLGSLLHWPCDFDLFLMNIFPYCTCISYVNSCLNPFLYAFFDPRFRQACTSMLCCGQSRCAGTSHSSSGEKSASYSSGHSQGPGPNMGKGGEQMHEKSIPYSQETLVVD
UniProtP35414
Protein Data Bank5vbl
GPCR-HGmod modelP35414
3D structure modelThis structure is from PDB ID 5vbl.
BioLiPBL0380094, BL0380093
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL1628481
IUPHAR36
DrugBankN/A

Ligand

NameCHEMBL3818742
Molecular formulaC24H24FN3O3
IUPAC name(2S)-2-cyclohexyl-2-[[1-(4-fluorophenyl)-5-phenylpyrazole-3-carbonyl]amino]acetic acid
Molecular weight421.472
Hydrogen bond acceptor5
Hydrogen bond donor2
XlogP5.3
SynonymsBDBM50183357
SCHEMBL17326476
Inchi KeyAROICVXZIHBWSI-QFIPXVFZSA-N
Inchi IDInChI=1S/C24H24FN3O3/c25-18-11-13-19(14-12-18)28-21(16-7-3-1-4-8-16)15-20(27-28)23(29)26-22(24(30)31)17-9-5-2-6-10-17/h1,3-4,7-8,11-15,17,22H,2,5-6,9-10H2,(H,26,29)(H,30,31)/t22-/m0/s1
PubChem CID118568780
ChEMBLCHEMBL3818742
IUPHARN/A
BindingDB50183357
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
EC50<30000.0 nMPMID27369451BindingDB,ChEMBL

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