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GPCR

NameThyrotropin receptor
SpeciesHomo sapiens (Human)
GeneTSHR
SynonymThyroid-stimulating hormone receptor
TSH receptor
Thyrotropin Receptor
TSH-R
LGR3
DiseaseDiagnostic test to differentiate primary and secondary hypothyroidism
Thyroid cancer
Thyroid cancer diagnosis
Length764
Amino acid sequenceMRPADLLQLVLLLDLPRDLGGMGCSSPPCECHQEEDFRVTCKDIQRIPSLPPSTQTLKLIETHLRTIPSHAFSNLPNISRIYVSIDVTLQQLESHSFYNLSKVTHIEIRNTRNLTYIDPDALKELPLLKFLGIFNTGLKMFPDLTKVYSTDIFFILEITDNPYMTSIPVNAFQGLCNETLTLKLYNNGFTSVQGYAFNGTKLDAVYLNKNKYLTVIDKDAFGGVYSGPSLLDVSQTSVTALPSKGLEHLKELIARNTWTLKKLPLSLSFLHLTRADLSYPSHCCAFKNQKKIRGILESLMCNESSMQSLRQRKSVNALNSPLHQEYEENLGDSIVGYKEKSKFQDTHNNAHYYVFFEEQEDEIIGFGQELKNPQEETLQAFDSHYDYTICGDSEDMVCTPKSDEFNPCEDIMGYKFLRIVVWFVSLLALLGNVFVLLILLTSHYKLNVPRFLMCNLAFADFCMGMYLLLIASVDLYTHSEYYNHAIDWQTGPGCNTAGFFTVFASELSVYTLTVITLERWYAITFAMRLDRKIRLRHACAIMVGGWVCCFLLALLPLVGISSYAKVSICLPMDTETPLALAYIVFVLTLNIVAFVIVCCCYVKIYITVRNPQYNPGDKDTKIAKRMAVLIFTDFICMAPISFYALSAILNKPLITVSNSKILLVLFYPLNSCANPFLYAIFTKAFQRDVFILLSKFGICKRQAQAYRGQRVPPKNSTDIQVQKVTHDMRQGLHNMEDVYELIENSHLTPKKQGQISEEYMQTVL
UniProtP16473
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseT60606
ChEMBLCHEMBL1963
IUPHAR255
DrugBankN/A

Ligand

NameAC1MDGXB
Molecular formulaC13H14N2O3
IUPAC nameethyl 2-(4-oxo-3H-phthalazin-1-yl)propanoate
Molecular weight246.266
Hydrogen bond acceptor4
Hydrogen bond donor1
XlogP2.0
Synonyms2-(4-Oxo-3,4-dihydro-phthalazin-1-yl)-propionic acid ethyl ester
AB00076427-01
AFYCPQBUUSDCLM-UHFFFAOYSA-N
AKOS000605406
BAS 02069612
[ Show all ]
Inchi KeyAFYCPQBUUSDCLM-UHFFFAOYSA-N
Inchi IDInChI=1S/C13H14N2O3/c1-3-18-13(17)8(2)11-9-6-4-5-7-10(9)12(16)15-14-11/h4-8H,3H2,1-2H3,(H,15,16)
PubChem CID2836660
ChEMBLCHEMBL1471577
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
Potency3162.3 nMPubChem BioAssay data setChEMBL

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