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GPCR

NameUrotensin-2 receptor
SpeciesRattus norvegicus (Rat)
GeneUts2r
SynonymUT receptor
urotensin II receptor
UR-II-R
UR-2-R
UII-R1
[ Show all ]
DiseaseN/A for non-human GPCRs
Length386
Amino acid sequenceMALSLESTTSFHMLTVSGSTVTELPGDSNVSLNSSWSGPTDPSSLKDLVATGVIGAVLSAMGVVGMVGNVYTLVVMCRFLRASASMYVYVVNLALADLLYLLSIPFIIATYVTKDWHFGDVGCRVLFSLDFLTMHASIFTLTIMSSERYAAVLRPLDTVQRSKGYRKLLVLGTWLLALLLTLPMMLAIQLVRRGSKSLCLPAWGPRAHRTYLTLLFGTSIVGPGLVIGLLYVRLARAYWLSQQASFKQTRRLPNPRVLYLILGIVLLFWACFLPFWLWQLLAQYHEAMPLTPETARIVNYLTTCLTYGNSCINPFLYTLLTKNYREYLRGRQRSLGSSCHSPGSPGSFLPSRVHLQQDSGRSLSSSSQQATETLMLSPVPRNGALL
UniProtP49684
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4921
IUPHAR365
DrugBankN/A

Ligand

NameCHEMBL1163467
Molecular formulaC59H79N13O16S2
IUPAC name(2S)-2-[[(4R,7S,10S,13S,16S,19R)-19-[[(2S)-2-[[(2S)-2-[[(2S,3R)-2-[(2-aminoacetyl)amino]-3-hydroxybutanoyl]amino]propanoyl]amino]-3-carboxypropanoyl]amino]-10-(4-aminobutyl)-16-benzyl-7-[(4-hydroxyphenyl)methyl]-13-(1H-indol-3-ylmethyl)-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]amino]-3-methylbutanoic acid
Molecular weight1290.48
Hydrogen bond acceptor20
Hydrogen bond donor17
XlogP-4.7
SynonymsBDBM50320455
GTAD[CFWKYC]V
Inchi KeyNUFGTERGVSMPEB-SWFTWZSLSA-N
Inchi IDInChI=1S/C59H79N13O16S2/c1-30(2)48(59(87)88)72-57(85)45-29-90-89-28-44(69-55(83)43(25-47(76)77)65-50(78)31(3)63-58(86)49(32(4)73)71-46(75)26-61)56(84)67-40(22-33-12-6-5-7-13-33)52(80)68-42(24-35-27-62-38-15-9-8-14-37(35)38)54(82)64-39(16-10-11-21-60)51(79)66-41(53(81)70-45)23-34-17-19-36(74)20-18-34/h5-9,12-15,17-20,27,30-32,39-45,48-49,62,73-74H,10-11,16,21-26,28-29,60-61H2,1-4H3,(H,63,86)(H,64,82)(H,65,78)(H,66,79)(H,67,84)(H,68,80)(H,69,83)(H,70,81)(H,71,75)(H,72,85)(H,76,77)(H,87,88)/t31-,32+,39-,40-,41-,42-,43-,44-,45-,48-,49-/m0/s1
PubChem CID10898540
ChEMBLCHEMBL1163467
IUPHARN/A
BindingDB50320455
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
EC500.29 nMPMID20043680BindingDB,ChEMBL

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