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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

NameCHEMBL2371351
Molecular formulaC80H118ClN21O12
IUPAC name(2S)-1-[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2S)-2-[[(2S)-2-[[(2R)-2-[[(2R)-2-[[(2R)-2-acetamido-7-[bis(ethylamino)methylideneamino]heptanoyl]amino]-3-(4-chlorophenyl)propanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]-3-hydroxypropanoyl]amino]-5-[bis(ethylamino)methylideneamino]pentanoyl]amino]-3-naphthalen-2-ylpropanoyl]amino]-4-methylpentanoyl]amino]-5-(diaminomethylideneamino)pentanoyl]-N-[(2R)-1-amino-1-oxopropan-2-yl]pyrrolidine-2-carboxamide
Molecular weight1601.41
Hydrogen bond acceptor15
Hydrogen bond donor18
XlogP4.1
SynonymsN/A
Inchi KeyAWJABNCATKJFEC-AAISRFOOSA-N
Inchi IDInChI=1S/C80H118ClN21O12/c1-9-85-79(86-10-2)90-37-19-13-14-27-59(94-50(8)104)69(106)98-63(43-51-32-35-56(81)36-33-51)72(109)100-65(45-55-46-92-58-26-18-17-25-57(55)58)74(111)101-66(47-103)75(112)95-60(28-20-39-91-80(87-11-3)88-12-4)70(107)99-64(44-52-31-34-53-23-15-16-24-54(53)42-52)73(110)97-62(41-48(5)6)71(108)96-61(29-21-38-89-78(83)84)77(114)102-40-22-30-67(102)76(113)93-49(7)68(82)105/h15-18,23-26,31-36,42,46,48-49,59-67,92,103H,9-14,19-22,27-30,37-41,43-45,47H2,1-8H3,(H2,82,105)(H,93,113)(H,94,104)(H,95,112)(H,96,108)(H,97,110)(H,98,106)(H,99,107)(H,100,109)(H,101,111)(H4,83,84,89)(H2,85,86,90)(H2,87,88,91)/t49-,59-,60+,61+,62+,63-,64-,65-,66+,67+/m1/s1
PubChem CID73347072
ChEMBLCHEMBL2371351
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand has more than 5 hydrogen bond donor.
This ligand has more than 10 hydrogen bond acceptor.
This ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
ED50<16.0 ug injection-1PMID2447279ChEMBL

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