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GPCR

NameGrowth hormone-releasing hormone receptor
SpeciesRattus norvegicus (Rat)
GeneGhrhr
SynonymGhrfr
GHRH receptor
GRF receptor
GRFR
Growth hormone-releasing factor receptor
DiseaseN/A for non-human GPCRs
Length464
Amino acid sequenceMDSLLWATWVLCLLNLWGVALGHLHLECDFITQLRDDELACLQAAEGTNNSSMGCPGTWDGLLCWPPTGSGQWVSLPCPEFFSHFGSDPGAVKRDCTITGWSDPFPPYPVACPVPLELLTEEKSYFSTVKIIYTTGHSISIVALCVAIAILVALRRLHCPRNYIHTQLFATFILKASAVFLKDAAVFQGDSTDHCSMSTILCKVSVAVSHFATMTNFSWLLAEAVYLSCLLASTSPRSKPAFWWLVLAGWGLPVLCTGTWVGCKLAFEDTACWDLDDSSPYWWIIKGPIVLSVGVNFGLFLNIICILLRKLGPAQGGLHTRAQYCNYLLPWSCPLPQVPRERTDLGPSSHEITVQESGTRNCQLPWRLSKSTLLLIPLFGIHYIIFNFLPDSAGLGIRLPLELGLGSFQGFVVAVLYCFLNQEVRTEISRKWYGHDPELLPARRTCTEWTTPPRSRVKVLTSEC
UniProtQ02644
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL3709
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL1791193
Molecular formulaC146H239N43O42S
IUPAC name(3S)-4-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S,3R)-1-[[(2S)-4-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-6-amino-1-[[(2S)-1-[[(2S)-1-[[2-[[(2S)-5-amino-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-5-amino-1-[[(2S)-1-[[(2S,3S)-1-[[(2S)-1-[[(2S)-1-[[(2S)-1-amino-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methylsulfanyl-1-oxobutan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-3-carboxy-1-oxopropan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-4-methyl-1-oxopentan-2-yl]amino]-1,5-dioxopentan-2-yl]amino]-2-oxoethyl]amino]-4-methyl-1-oxopentan-2-yl]amino]-3-methyl-1-oxobutan-2-yl]amino]-1-oxohexan-2-yl]amino]-5-(diaminomethylideneamino)-1-oxopentan-2-yl]amino]-3-(4-hydroxyphenyl)-1-oxopropan-2-yl]amino]-3-hydroxy-1-oxopropan-2-yl]amino]-1,4-dioxobutan-2-yl]amino]-3-hydroxy-1-oxobutan-2-yl]amino]-1-oxo-3-phenylpropan-2-yl]amino]-3-methyl-1-oxopentan-2-yl]amino]-1-oxopropan-2-yl]amino]-3-[[(2S)-2-[[(2S)-2-amino-3-(4-hydroxyphenyl)propanoyl]amino]propanoyl]amino]-4-oxobutanoic acid
Molecular weight3300.84
Hydrogen bond acceptor48
Hydrogen bond donor48
XlogP-13.0
SynonymsN/A
Inchi KeyFBKSWCSPUKXBJE-GEWCFVQXSA-N
Inchi IDInChI=1S/C146H239N43O42S/c1-21-74(13)113(187-120(208)79(18)165-129(217)101(63-110(200)201)175-118(206)76(15)163-121(209)86(148)59-82-37-41-84(194)42-38-82)142(230)181-99(60-81-31-24-23-25-32-81)135(223)189-115(80(19)193)143(231)182-100(62-108(151)198)134(222)185-105(68-192)139(227)178-98(61-83-39-43-85(195)44-40-83)133(221)171-90(36-30-53-161-146(157)158)124(212)170-88(33-26-27-50-147)128(216)186-112(73(11)12)140(228)180-94(55-69(3)4)122(210)162-65-109(199)167-91(45-47-106(149)196)125(213)176-97(58-72(9)10)132(220)184-103(66-190)137(225)166-77(16)117(205)169-89(35-29-52-160-145(155)156)123(211)164-78(17)119(207)174-95(56-70(5)6)131(219)177-96(57-71(7)8)130(218)172-92(46-48-107(150)197)126(214)179-102(64-111(202)203)136(224)188-114(75(14)22-2)141(229)173-93(49-54-232-20)127(215)183-104(67-191)138(226)168-87(116(152)204)34-28-51-159-144(153)154/h23-25,31-32,37-44,69-80,86-105,112-115,190-195H,21-22,26-30,33-36,45-68,147-148H2,1-20H3,(H2,149,196)(H2,150,197)(H2,151,198)(H2,152,204)(H,162,210)(H,163,209)(H,164,211)(H,165,217)(H,166,225)(H,167,199)(H,168,226)(H,169,205)(H,170,212)(H,171,221)(H,172,218)(H,173,229)(H,174,207)(H,175,206)(H,176,213)(H,177,219)(H,178,227)(H,179,214)(H,180,228)(H,181,230)(H,182,231)(H,183,215)(H,184,220)(H,185,222)(H,186,216)(H,187,208)(H,188,224)(H,189,223)(H,200,201)(H,202,203)(H4,153,154,159)(H4,155,156,160)(H4,157,158,161)/t74-,75-,76-,77-,78-,79-,80+,86-,87-,88-,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,112-,113-,114-,115-/m0/s1
PubChem CID56664719
ChEMBLCHEMBL1791193
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
Relative potency0.27 -PMID9513600ChEMBL

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