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GPCR

NameVasopressin V1a receptor
SpeciesHomo sapiens (Human)
GeneAVPR1A
SynonymAVPR V1a
AVPR
Antidiuretic hormone receptor 1a
AVPR1
V1A receptor
[ Show all ]
DiseaseEuvolemic hyponatremia
Hyponatraemia
Dysmenorrhea
Cardiotonic
Infertility
[ Show all ]
Length418
Amino acid sequenceMRLSAGPDAGPSGNSSPWWPLATGAGNTSREAEALGEGNGPPRDVRNEELAKLEIAVLAVTFAVAVLGNSSVLLALHRTPRKTSRMHLFIRHLSLADLAVAFFQVLPQMCWDITYRFRGPDWLCRVVKHLQVFGMFASAYMLVVMTADRYIAVCHPLKTLQQPARRSRLMIAAAWVLSFVLSTPQYFVFSMIEVNNVTKARDCWATFIQPWGSRAYVTWMTGGIFVAPVVILGTCYGFICYNIWCNVRGKTASRQSKGAEQAGVAFQKGFLLAPCVSSVKSISRAKIRTVKMTFVIVTAYIVCWAPFFIIQMWSVWDPMSVWTESENPTITITALLGSLNSCCNPWIYMFFSGHLLQDCVQSFPCCQNMKEKFNKEDTDSMSRRQTFYSNNRSPTNSTGMWKDSPKSSKSIKFIPVST
UniProtP37288
Protein Data BankN/A
GPCR-HGmod modelP37288
3D structure modelThis predicted structure model is from GPCR-EXP P37288.
BioLiPN/A
Therapeutic Target DatabaseT79232
ChEMBLCHEMBL1889
IUPHAR366
DrugBankBE0000165

Ligand

NameCHEMBL1092499
Molecular formulaC18H20FN3O3
IUPAC name3-(4-fluoro-2-methylphenoxy)-N-(6-methoxypyridin-3-yl)-N-methylazetidine-1-carboxamide
Molecular weight345.374
Hydrogen bond acceptor5
Hydrogen bond donor0
XlogP2.5
Synonyms3-(4-fluoro-2-methylphenoxy)-N-(6-methoxypyridin-3-yl)-N-methylazetidine-1-carboxamide
BDBM50313810
Inchi KeyAHFWVQQNXZZLQH-UHFFFAOYSA-N
Inchi IDInChI=1S/C18H20FN3O3/c1-12-8-13(19)4-6-16(12)25-15-10-22(11-15)18(23)21(2)14-5-7-17(24-3)20-9-14/h4-9,15H,10-11H2,1-3H3
PubChem CID46881861
ChEMBLCHEMBL1092499
IUPHARN/A
BindingDB50313810
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki1300.0 nMPMID20172721BindingDB,ChEMBL

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