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GPCR

NameLutropin-choriogonadotropic hormone receptor
SpeciesRattus norvegicus (Rat)
GeneLhcgr
SynonymLuteinizing hormone receptor
LSH-R
LHR
LH/CG-R
LH-R
[ Show all ]
DiseaseN/A for non-human GPCRs
Length700
Amino acid sequenceMGRRVPALRQLLVLAVLLLKPSQLQSRELSGSRCPEPCDCAPDGALRCPGPRAGLARLSLTYLPVKVIPSQAFRGLNEVVKIEISQSDSLERIEANAFDNLLNLSELLIQNTKNLLYIEPGAFTNLPRLKYLSICNTGIRTLPDVTKISSSEFNFILEICDNLHITTIPGNAFQGMNNESVTLKLYGNGFEEVQSHAFNGTTLISLELKENIYLEKMHSGAFQGATGPSILDISSTKLQALPSHGLESIQTLIALSSYSLKTLPSKEKFTSLLVATLTYPSHCCAFRNLPKKEQNFSFSIFENFSKQCESTVRKADNETLYSAIFEENELSGWDYDYGFCSPKTLQCAPEPDAFNPCEDIMGYAFLRVLIWLINILAIFGNLTVLFVLLTSRYKLTVPRFLMCNLSFADFCMGLYLLLIASVDSQTKGQYYNHAIDWQTGSGCGAAGFFTVFASELSVYTLTVITLERWHTITYAVQLDQKLRLRHAIPIMLGGWLFSTLIATMPLVGISNYMKVSICLPMDVESTLSQVYILSILILNVVAFVVICACYIRIYFAVQNPELTAPNKDTKIAKKMAILIFTDFTCMAPISFFAISAAFKVPLITVTNSKILLVLFYPVNSCANPFLYAIFTKAFQRDFLLLLSRFGCCKRRAELYRRKEFSAYTSNCKNGFPGASKPSQATLKLSTVHCQQPIPPRALTH
UniProtP16235
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2456
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL413887
Molecular formulaC56H73N11O9
IUPAC name1-[(2S)-5-(diaminomethylideneamino)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-3-hydroxy-2-[4-(1H-indol-3-yl)butanoylamino]propanoyl]amino]-3-(4-hydroxyphenyl)propanoyl]amino]-3-naphthalen-2-ylpropanoyl]amino]-4-methylpentanoyl]amino]pentanoyl]-N-ethylpyrrolidine-2-carboxamide
Molecular weight1044.27
Hydrogen bond acceptor10
Hydrogen bond donor11
XlogP4.2
SynonymsBDBM50405782
Inchi KeyCMOKQRSZSSBVCR-NKSNMKHQSA-N
Inchi IDInChI=1S/C56H73N11O9/c1-4-59-54(75)48-18-11-27-67(48)55(76)43(17-10-26-60-56(57)58)63-50(71)44(28-34(2)3)64-52(73)46(31-36-20-23-37-12-5-6-13-38(37)29-36)65-51(72)45(30-35-21-24-40(69)25-22-35)66-53(74)47(33-68)62-49(70)19-9-14-39-32-61-42-16-8-7-15-41(39)42/h5-8,12-13,15-16,20-25,29,32,34,43-48,61,68-69H,4,9-11,14,17-19,26-28,30-31,33H2,1-3H3,(H,59,75)(H,62,70)(H,63,71)(H,64,73)(H,65,72)(H,66,74)(H4,57,58,60)/t43-,44-,45-,46+,47-,48?/m0/s1
PubChem CID44315220
ChEMBLCHEMBL413887
IUPHARN/A
BindingDB50405782
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
Kd8.51 nMPMID2552116BindingDB
Kd8.511 nMPMID2552116ChEMBL
Ki1.38 nMPMID2552116ChEMBL

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