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GPCR

NameProstaglandin E2 receptor EP1 subtype
SpeciesHomo sapiens (Human)
GenePTGER1
SynonymPGE receptor EP1 subtype
EP1 receptor
prostaglandin E receptor 1 (subtype EP1), 42kDa
Prostanoid EP1 receptor
EP1 prostanoid receptor
[ Show all ]
DiseaseUnspecified
Thrombosis
Pollakiuria
Pain
Length402
Amino acid sequenceMSPCGPLNLSLAGEATTCAAPWVPNTSAVPPSGASPALPIFSMTLGAVSNLLALALLAQAAGRLRRRRSAATFLLFVASLLATDLAGHVIPGALVLRLYTAGRAPAGGACHFLGGCMVFFGLCPLLLGCGMAVERCVGVTRPLLHAARVSVARARLALAAVAAVALAVALLPLARVGRYELQYPGTWCFIGLGPPGGWRQALLAGLFASLGLVALLAALVCNTLSGLALLRARWRRRSRRPPPASGPDSRRRWGAHGPRSASASSASSIASASTFFGGSRSSGSARRARAHDVEMVGQLVGIMVVSCICWSPMLVLVALAVGGWSSTSLQRPLFLAVRLASWNQILDPWVYILLRQAVLRQLLRLLPPRAGAKGGPAGLGLTPSAWEASSLRSSRHSGLSHF
UniProtP34995
Protein Data BankN/A
GPCR-HGmod modelP34995
3D structure modelThis predicted structure model is from GPCR-EXP P34995.
BioLiPN/A
Therapeutic Target DatabaseT15497
ChEMBLCHEMBL1811
IUPHAR340
DrugBankBE0000064

Ligand

NameSCHEMBL2841361
Molecular formulaC22H17N3O2S
IUPAC name(E)-3-[2-(4-methyl-3,5-diphenylpyrazol-1-yl)-1,3-thiazol-4-yl]prop-2-enoic acid
Molecular weight387.457
Hydrogen bond acceptor5
Hydrogen bond donor1
XlogP4.9
SynonymsSCHEMBL2841365
CHEMBL3092148
Inchi KeyAADUQEJYBCZCAP-OUKQBFOZSA-N
Inchi IDInChI=1S/C22H17N3O2S/c1-15-20(16-8-4-2-5-9-16)24-25(21(15)17-10-6-3-7-11-17)22-23-18(14-28-22)12-13-19(26)27/h2-14H,1H3,(H,26,27)/b13-12+
PubChem CID59179264
ChEMBLCHEMBL3092148
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
IC50500.0 nMPMID24252546ChEMBL

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