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GPCR

NameGonadotropin-releasing hormone receptor
SpeciesRattus norvegicus (Rat)
GeneGnrhr
Synonymluteinizing hormone-releasing hormone (LHRH) receptor
luliberin receptor
LHRHR
LHRH receptor
GNRHR1
[ Show all ]
DiseaseN/A for non-human GPCRs
Length327
Amino acid sequenceMANNASLEQDQNHCSAINNSIPLTQGKLPTLTLSGKIRVTVTFFLFLLSTAFNASFLVKLQRWTQKRKKGKKLSRMKVLLKHLTLANLLETLIVMPLDGMWNITVQWYAGEFLCKVLSYLKLFSMYAPAFMMVVISLDRSLAVTQPLAVQSKSKLERSMTSLAWILSIVFAGPQLYIFRMIYLADGSGPAVFSQCVTHCSFPQWWHEAFYNFFTFSCLFIIPLLIMLICNAKIIFALTRVLHQDPRKLQLNQSKNNIPRARLRTLKMTVAFGTSFVICWTPYYVLGIWYWFDPEMLNRVSEPVNHFFFLFAFLNPCFDPLIYGYFSL
UniProtP30969
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3066
IUPHAR256
DrugBankN/A

Ligand

NameCHEMBL3144569
Molecular formulaC40H43Cl2N7O6
IUPAC name2,2-diphenylethyl (2S)-2-[[(2S)-1-[[(2R,4S)-2-(2,4-dichlorophenyl)-2-(imidazol-1-ylmethyl)-1,3-dioxolan-4-yl]methylamino]-3-(2,3-dihydro-1H-imidazol-4-yl)-1-oxopropan-2-yl]carbamoyl]pyrrolidine-1-carboxylate
Molecular weight788.727
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP5.1
SynonymsBDBM50228319
Inchi KeyBCSIYDBZSNGYAC-IAKKGAPTSA-N
Inchi IDInChI=1S/C40H43Cl2N7O6/c41-29-13-14-33(34(42)18-29)40(24-48-17-15-43-26-48)54-22-31(55-40)21-45-37(50)35(19-30-20-44-25-46-30)47-38(51)36-12-7-16-49(36)39(52)53-23-32(27-8-3-1-4-9-27)28-10-5-2-6-11-28/h1-6,8-11,13-15,17-18,20,26,31-32,35-36,44,46H,7,12,16,19,21-25H2,(H,45,50)(H,47,51)/t31-,35-,36-,40-/m0/s1
PubChem CID90663998
ChEMBLCHEMBL3144569
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.
This ligand has a partition coefficient log P greater than 5.

Experimental Data

ParameterValueReferenceDatabase source
IC50480.0 nMPMID2549244ChEMBL

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