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GPCR

NameSomatostatin receptor type 5
SpeciesRattus norvegicus (Rat)
GeneSstr5
SynonymSOMATO
SS-5-R
SS5-R
SS5R
SST5 receptor
DiseaseN/A for non-human GPCRs
Length363
Amino acid sequenceMEPLSLASTPSWNASAASSGNHNWSLVGSASPMGARAVLVPVLYLLVCTVGLSGNTLVIYVVLRHAKMKTVTNVYILNLAVADVLFMLGLPFLATQNAVVSYWPFGSFLCRLVMTLDGINQFTSIFCLMVMSVDRYLAVVHPLRSARWRRPRVAKMASAAVWVFSLLMSLPLLVFADVQEGWGTCNLSWPEPVGLWGAAFITYTSVLGFFGPLLVICLCYLLIVVKVKAAGMRVGSSRRRRSEPKVTRMVVVVVLVFVGCWLPFFIVNIVNLAFTLPEEPTSAGLYFFVVVLSYANSCANPLLYGFLSDNFRQSFRKVLCLRRGYGMEDADAIEPRPDKSGRPQATLPTRSCEANGLMQTSRI
UniProtP30938
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4318
IUPHAR359
DrugBankN/A

Ligand

NameBDBM85230
Molecular formulaC54H69N11O9S2
IUPAC name(2S)-6-amino-N-[(2R)-1-[[1-[(1-amino-1-oxo-3-sulfanylpropan-2-yl)amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]-2-[[(2R)-2-[[(2S)-2-[[2-[(2-amino-3-sulfanylpropanoyl)amino]-3-phenylpropanoyl]amino]-3-phenylpropanoyl]amino]-3-(1H-indol-3-yl)propanoyl]amino]hexanamide
Molecular weight1080.33
Hydrogen bond acceptor13
Hydrogen bond donor14
XlogP2.3
SynonymsBIM 23313
Inchi KeyLBRSAPKITPIKNC-NPCZSIKFSA-N
Inchi IDInChI=1S/C54H69N11O9S2/c1-32(66)46(54(74)63-43(27-35-19-9-4-10-20-35)52(72)64-45(31-76)47(57)67)65-49(69)40(23-13-14-24-55)59-53(73)44(28-36-29-58-39-22-12-11-21-37(36)39)62-51(71)42(26-34-17-7-3-8-18-34)61-50(70)41(60-48(68)38(56)30-75)25-33-15-5-2-6-16-33/h2-12,15-22,29,32,38,40-46,58,66,75-76H,13-14,23-28,30-31,55-56H2,1H3,(H2,57,67)(H,59,73)(H,60,68)(H,61,70)(H,62,71)(H,63,74)(H,64,72)(H,65,69)/t32?,38?,40-,41?,42-,43?,44+,45?,46+/m0/s1
PubChem CID57340027
ChEMBLN/A
IUPHARN/A
BindingDB85230
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
Ki9.88 nMPMID9600011BindingDB

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