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GPCR

NameGrowth hormone secretagogue receptor type 1
SpeciesHomo sapiens (Human)
GeneGHSR
Synonymghrelin receptor
GH-releasing peptide receptor
GHRP
GHS-R
growth hormone-releasing peptide receptor
[ Show all ]
DiseaseN/A
Length366
Amino acid sequenceMWNATPSEEPGFNLTLADLDWDASPGNDSLGDELLQLFPAPLLAGVTATCVALFVVGIAGNLLTMLVVSRFRELRTTTNLYLSSMAFSDLLIFLCMPLDLVRLWQYRPWNFGDLLCKLFQFVSESCTYATVLTITALSVERYFAICFPLRAKVVVTKGRVKLVIFVIWAVAFCSAGPIFVLVGVEHENGTDPWDTNECRPTEFAVRSGLLTVMVWVSSIFFFLPVFCLTVLYSLIGRKLWRRRRGDAVVGASLRDQNHKQTVKMLAVVVFAFILCWLPFHVGRYLFSKSFEPGSLEIAQISQYCNLVSFVLFYLSAAINPILYNIMSKKYRVAVFRLLGFEPFSQRKLSTLKDESSRAWTESSINT
UniProtQ92847
Protein Data BankN/A
GPCR-HGmod modelQ92847
3D structure modelThis predicted structure model is from GPCR-EXP Q92847.
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4616
IUPHAR246
DrugBankBE0003383

Ligand

NameCHEMBL1080162
Molecular formulaC26H24N4O2
IUPAC name[(3S)-4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-yl]-(4-pyridin-3-ylphenyl)methanone
Molecular weight424.504
Hydrogen bond acceptor3
Hydrogen bond donor1
XlogP3.4
Synonyms(S)-(4-(1H-indole-6-carbonyl)-3-methylpiperazin-1-yl)(4-(pyridin-3-yl)phenyl)methanone
BDBM50312794
Inchi KeyMHGREHPRCJCUIW-SFHVURJKSA-N
Inchi IDInChI=1S/C26H24N4O2/c1-18-17-29(25(31)21-7-4-19(5-8-21)23-3-2-11-27-16-23)13-14-30(18)26(32)22-9-6-20-10-12-28-24(20)15-22/h2-12,15-16,18,28H,13-14,17H2,1H3/t18-/m0/s1
PubChem CID46880811
ChEMBLCHEMBL1080162
IUPHARN/A
BindingDB50312794
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
IC50143.0 nMPMID20137933BindingDB,ChEMBL

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