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GPCR

NameProstaglandin E2 receptor EP3 subtype
SpeciesHomo sapiens (Human)
GenePTGER3
SynonymEP3 receptor
Prostanoid EP3 receptor
prostaglandin E receptor 3
PGE2 receptor EP3 subtype
PGE2-R
[ Show all ]
DiseaseAsthma
Glaucoma
Pain
Peripheral vascular disease
Length390
Amino acid sequenceMKETRGYGGDAPFCTRLNHSYTGMWAPERSAEARGNLTRPPGSGEDCGSVSVAFPITMLLTGFVGNALAMLLVSRSYRRRESKRKKSFLLCIGWLALTDLVGQLLTTPVVIVVYLSKQRWEHIDPSGRLCTFFGLTMTVFGLSSLFIASAMAVERALAIRAPHWYASHMKTRATRAVLLGVWLAVLAFALLPVLGVGQYTVQWPGTWCFISTGRGGNGTSSSHNWGNLFFASAFAFLGLLALTVTFSCNLATIKALVSRCRAKATASQSSAQWGRITTETAIQLMGIMCVLSVCWSPLLIMMLKMIFNQTSVEHCKTHTEKQKECNFFLIAVRLASLNQILDPWVYLLLRKILLRKFCQIRYHTNNYASSSTSLPCQCSSTLMWSDHLER
UniProtP43115
Protein Data Bank6m9t
GPCR-HGmod modelP43115
3D structure modelThis structure is from PDB ID 6m9t.
BioLiPBL0434681
Therapeutic Target DatabaseT85467
ChEMBLCHEMBL3710
IUPHAR342
DrugBankBE0002375

Ligand

NameGW9508
Molecular formulaC22H21NO3
IUPAC name3-[4-[(3-phenoxyphenyl)methylamino]phenyl]propanoic acid
Molecular weight347.414
Hydrogen bond acceptor4
Hydrogen bond donor2
XlogP4.7
Synonyms3-(4-((3-Phenoxybenzyl)amino)phenyl)propanoic acid
3-(4-(3-phenoxybenzylamino)phenyl)propanoic acid
3-(4-{[(3-phenoxyphenyl)methyl]amino}phenyl)propanoic acid
3-[4-(3-Phenoxybenzylamino)phenyl]propanoic acid
4-(3-Phenoxybenzylamino)phenylpropionic acid
[ Show all ]
Inchi KeyDGENZVKCTGIDRZ-UHFFFAOYSA-N
Inchi IDInChI=1S/C22H21NO3/c24-22(25)14-11-17-9-12-19(13-10-17)23-16-18-5-4-8-21(15-18)26-20-6-2-1-3-7-20/h1-10,12-13,15,23H,11,14,16H2,(H,24,25)
PubChem CID11595431
ChEMBLCHEMBL207881
IUPHAR1050
BindingDB22496
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
Ki398.11 nMPMID17240142ChEMBL

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