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GPCR

NameGrowth hormone secretagogue receptor type 1
SpeciesRattus norvegicus (Rat)
GeneGhsr
SynonymGH-releasing peptide receptor
Ghrelin receptor
ghrelin receptor 1a
GHRP
GHS-R
[ Show all ]
DiseaseN/A for non-human GPCRs
Length364
Amino acid sequenceMWNATPSEEPEPNVTLDLDWDASPGNDSLPDELLPLFPAPLLAGVTATCVALFVVGISGNLLTMLVVSRFRELRTTTNLYLSSMAFSDLLIFLCMPLDLVRLWQYRPWNFGDLLCKLFQFVSESCTYATVLTITALSVERYFAICFPLRAKVVVTKGRVKLVILVIWAVAFCSAGPIFVLVGVEHENGTDPRDTNECRATEFAVRSGLLTVMVWVSSVFFFLPVFCLTVLYSLIGRKLWRRRGDAAVGASLRDQNHKQTVKMLAVVVFAFILCWLPFHVGRYLFSKSFEPGSLEIAQISQYCNLVSFVLFYLSAAINPILYNIMSKKYRVAVFKLLGFESFSQRKLSTLKDESSRAWTKSSINT
UniProtO08725
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3278
IUPHAR246
DrugBankN/A

Ligand

NameCHEMBL434609
Molecular formulaC32H38F2N4O3
IUPAC name(E)-5-amino-N-[(2R)-1-[[(2R)-3-(3,4-difluorophenyl)-1-(methylamino)-1-oxopropan-2-yl]-methylamino]-3-naphthalen-2-yl-1-oxopropan-2-yl]-N,5-dimethylhex-2-enamide
Molecular weight564.678
Hydrogen bond acceptor6
Hydrogen bond donor2
XlogP4.4
SynonymsBDBM50066823
N-(5-Amino-5-methyl-2-hexenoyl)-N-methyl-3-(2-naphthyl)-D-Ala-N-methyl-3,4-difluoro-D-Phe-NHMe
(E)-5-Amino-5-methyl-hex-2-enoic acid ((R)-1-{[(R)-2-(3,4-difluoro-phenyl)-1-methylcarbamoyl-ethyl]-methyl-carbamoyl}-2-naphthalen-2-yl-ethyl)-methyl-amide
Inchi KeyBQAUKCBBJQOXNR-ODNGPVGPSA-N
Inchi IDInChI=1S/C32H38F2N4O3/c1-32(2,35)16-8-11-29(39)37(4)28(20-21-12-14-23-9-6-7-10-24(23)17-21)31(41)38(5)27(30(40)36-3)19-22-13-15-25(33)26(34)18-22/h6-15,17-18,27-28H,16,19-20,35H2,1-5H3,(H,36,40)/b11-8+/t27-,28-/m1/s1
PubChem CID10530983
ChEMBLCHEMBL434609
IUPHARN/A
BindingDBN/A
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand is heavier than 500 daltons.

Experimental Data

ParameterValueReferenceDatabase source
EC5017.0 nMPMID9733496ChEMBL
Emax85.0 %PMID9733496ChEMBL

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