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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

NameCHEMBL1791199
Molecular formulaC148H246N44O40S
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)-6-amino-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]-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-oxohexan-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 weight3313.92
Hydrogen bond acceptor47
Hydrogen bond donor48
XlogP-10.1
SynonymsN/A
Inchi KeyJVTKVVOKYXZEOK-PWIFUIGVSA-N
Inchi IDInChI=1S/C148H246N44O40S/c1-21-77(13)115(143(230)177-97(52-58-233-20)130(217)186-107(70-194)140(227)171-90(118(155)205)37-30-55-162-146(156)157)190-121(208)81(17)167-125(212)96(49-51-110(153)200)176-133(220)99(60-73(5)6)181-134(221)100(61-74(7)8)179-128(215)91(35-26-28-53-149)173-126(213)93(38-31-56-163-147(158)159)172-119(206)80(16)169-139(226)106(69-193)187-135(222)101(62-75(9)10)180-129(216)95(48-50-109(152)199)170-112(202)68-165-124(211)98(59-72(3)4)183-142(229)114(76(11)12)189-131(218)92(36-27-29-54-150)174-127(214)94(39-32-57-164-148(160)161)175-136(223)102(65-86-42-46-88(198)47-43-86)182-141(228)108(71-195)188-137(224)104(66-111(154)201)185-145(232)117(83(19)196)192-138(225)103(64-84-33-24-23-25-34-84)184-144(231)116(78(14)22-2)191-122(209)82(18)168-132(219)105(67-113(203)204)178-120(207)79(15)166-123(210)89(151)63-85-40-44-87(197)45-41-85/h23-25,33-34,40-47,72-83,89-108,114-117,193-198H,21-22,26-32,35-39,48-71,149-151H2,1-20H3,(H2,152,199)(H2,153,200)(H2,154,201)(H2,155,205)(H,165,211)(H,166,210)(H,167,212)(H,168,219)(H,169,226)(H,170,202)(H,171,227)(H,172,206)(H,173,213)(H,174,214)(H,175,223)(H,176,220)(H,177,230)(H,178,207)(H,179,215)(H,180,216)(H,181,221)(H,182,228)(H,183,229)(H,184,231)(H,185,232)(H,186,217)(H,187,222)(H,188,224)(H,189,218)(H,190,208)(H,191,209)(H,192,225)(H,203,204)(H4,156,157,162)(H4,158,159,163)(H4,160,161,164)/t77-,78-,79-,80-,81-,82-,83+,89-,90-,91-,92-,93-,94-,95-,96-,97-,98-,99-,100-,101-,102-,103-,104-,105-,106-,107-,108-,114-,115-,116-,117-/m0/s1
PubChem CID56668133
ChEMBLCHEMBL1791199
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 potency1.3 -PMID9513600ChEMBL

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