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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

NameMLS001165172
Molecular formulaC19H22N4
IUPAC nameN,N-dipropyl-2-pyridin-2-ylquinazolin-4-amine
Molecular weight306.413
Hydrogen bond acceptor4
Hydrogen bond donor0
XlogP4.4
SynonymsBDBM67331
MolPort-002-601-394
ZINC530007
cid_936147
N,N-dipropyl-2-pyridin-2-yl-quinazolin-4-amine
[ Show all ]
Inchi KeyCUPVITJALNDBTF-UHFFFAOYSA-N
Inchi IDInChI=1S/C19H22N4/c1-3-13-23(14-4-2)19-15-9-5-6-10-16(15)21-18(22-19)17-11-7-8-12-20-17/h5-12H,3-4,13-14H2,1-2H3
PubChem CID936147
ChEMBLCHEMBL1593888
IUPHARN/A
BindingDB67331
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC50<40000.0 nMN/ABindingDB

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