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GPCR

NameGastrin-releasing peptide receptor
SpeciesRattus norvegicus (Rat)
GeneGrpr
SynonymBB2
BB2 receptor
gastrin-releasing peptide receptor
GRP-preferring bombesin receptor
GRP-R
DiseaseN/A for non-human GPCRs
Length384
Amino acid sequenceMDPNNCSHLNLEVDPFLSCNNTFNQTLNPPKMDNWFHPGIIYVIPAVYGLIIVIGLIGNITLIKIFCTVKSMRNVPNLFISSLALGDLLLLVTCAPVDASKYLADRWLFGRIGCKLIPFIQLTSVGVSVFTLTALSADRYKAIVRPMDIQASHALMKICLKAALIWIVSMLLAIPEAVFSDLHPFHVKDTNQTFISCAPYPHSNELHPKIHSMASFLVFYIIPLSIISVYYYFIARNLIQSAYNLPVEGNIHVKKQIESRKRLAKTVLVFVGLFAFCWLPNHVIYLYRSYHYSEVDTSMLHFITSICARLLAFTNSCVNPFALYLLSKSFRKQFNTQLLCCQPSLLNRSHSTGRSTTCMTSFKSTNPSATFSLINGNICHEGYV
UniProtP52500
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4280
IUPHAR39
DrugBankN/A

Ligand

NameCHEMBL410615
Molecular formulaC51H71N13O10
IUPAC name(2S)-N-[(2S)-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-1-[[(2S)-1-acetamido-4-methylpentan-2-yl]amino]-3-(1H-imidazol-5-yl)-1-oxopropan-2-yl]amino]-2-oxoethyl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-(1H-indol-3-yl)-1-oxopropan-2-yl]-2-[[(2R)-2-acetamido-3-phenylpropanoyl]amino]pentanediamide
Molecular weight1026.21
Hydrogen bond acceptor11
Hydrogen bond donor12
XlogP1.3
SynonymsN/A
Inchi KeyWTKUIJOWPBUNLP-RGHKRINMSA-N
Inchi IDInChI=1S/C51H71N13O10/c1-28(2)19-36(25-54-31(6)65)60-49(72)42(22-35-24-53-27-57-35)61-44(68)26-56-51(74)45(29(3)4)64-46(69)30(5)58-48(71)41(21-34-23-55-38-16-12-11-15-37(34)38)63-47(70)39(17-18-43(52)67)62-50(73)40(59-32(7)66)20-33-13-9-8-10-14-33/h8-16,23-24,27-30,36,39-42,45,55H,17-22,25-26H2,1-7H3,(H2,52,67)(H,53,57)(H,54,65)(H,56,74)(H,58,71)(H,59,66)(H,60,72)(H,61,68)(H,62,73)(H,63,70)(H,64,69)/t30-,36-,39-,40+,41-,42-,45-/m0/s1
PubChem CID44361838
ChEMBLCHEMBL410615
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
Release3.0 %PMID1469698ChEMBL
Release4.3 %PMID1469698ChEMBL
Release14.8 %PMID1469698ChEMBL
Release16.5 %PMID1469698ChEMBL

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