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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

NameCHEMBL3104643
Molecular formulaC53H67N9O10S2
IUPAC name(2S)-2-[[(4R,7S,10S,13S,16S,19R)-10-(4-aminobutyl)-19-[[(2S)-2-aminopropanoyl]amino]-13-benzhydryl-16-benzyl-7-[(4-hydroxyphenyl)methyl]-6,9,12,15,18-pentaoxo-1,2-dithia-5,8,11,14,17-pentazacycloicosane-4-carbonyl]amino]-3-methylbutanoic acid
Molecular weight1054.29
Hydrogen bond acceptor14
Hydrogen bond donor11
XlogP1.5
SynonymsBDBM50445377
Inchi KeyKRQDIZGZRSRUEP-YKGHHLIPSA-N
Inchi IDInChI=1S/C53H67N9O10S2/c1-31(2)44(53(71)72)61-51(69)42-30-74-73-29-41(59-46(64)32(3)55)50(68)58-40(27-33-15-7-4-8-16-33)49(67)62-45(43(35-17-9-5-10-18-35)36-19-11-6-12-20-36)52(70)56-38(21-13-14-26-54)47(65)57-39(48(66)60-42)28-34-22-24-37(63)25-23-34/h4-12,15-20,22-25,31-32,38-45,63H,13-14,21,26-30,54-55H2,1-3H3,(H,56,70)(H,57,65)(H,58,68)(H,59,64)(H,60,66)(H,61,69)(H,62,67)(H,71,72)/t32-,38-,39-,40-,41-,42-,44-,45-/m0/s1
PubChem CID72793599
ChEMBLCHEMBL3104643
IUPHARN/A
BindingDB50445377
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
EC50<1e-06 nMPMID24251366ChEMBL
EC50<1e-06 nMPMID24251366BindingDB
EC50<1000.0 nMPMID24251366BindingDB,ChEMBL
Emax23.0 %PMID24251366ChEMBL

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