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GPCR

NameB2 bradykinin receptor
SpeciesRattus norvegicus (Rat)
GeneBdkrb2
SynonymB2 receptor
B2BKR
B2BRA
BK-2 receptor
BK2R
[ Show all ]
DiseaseN/A for non-human GPCRs
Length396
Amino acid sequenceMDTRSSLCPKTQAVVAVFWGPGCHLSTCIEMFNITTQALGSAHNGTFSEVNCPDTEWWSWLNAIQAPFLWVLFLLAALENIFVLSVFCLHKTNCTVAEIYLGNLAAADLILACGLPFWAITIANNFDWLFGEVLCRVVNTMIYMNLYSSICFLMLVSIDRYLALVKTMSMGRMRGVRWAKLYSLVIWSCTLLLSSPMLVFRTMKDYREEGHNVTACVIVYPSRSWEVFTNMLLNLVGFLLPLSIITFCTVRIMQVLRNNEMKKFKEVQTEKKATVLVLAVLGLFVLCWFPFQISTFLDTLLRLGVLSGCWNERAVDIVTQISSYVAYSNSCLNPLVYVIVGKRFRKKSREVYQAICRKGGCMGESVQMENSMGTLRTSISVDRQIHKLQDWAGNKQ
UniProtP25023
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL2501
IUPHAR42
DrugBankN/A

Ligand

NameCHEMBL352459
Molecular formulaC17H17N5O6S2
IUPAC name1-(furan-2-ylmethyl)-3-[4-(furan-2-ylmethylsulfamoyl)-2-nitroanilino]thiourea
Molecular weight451.472
Hydrogen bond acceptor9
Hydrogen bond donor4
XlogP2.4
Synonyms1-[2-Nitro-4-(2-furanylmethylsulfamoyl)phenyl]-4-(2-furanylmethyl)thiosemicarbazide
BDBM50085692
2-{4-[2-furylmethylamino(thioxo)methylhydrazine]-3-nitrophenylsulfonamidomethyl}furan
Inchi KeyYPEPVGSAMZZBGJ-UHFFFAOYSA-N
Inchi IDInChI=1S/C17H17N5O6S2/c23-22(24)16-9-14(30(25,26)19-11-13-4-2-8-28-13)5-6-15(16)20-21-17(29)18-10-12-3-1-7-27-12/h1-9,19-20H,10-11H2,(H2,18,21,29)
PubChem CID10742229
ChEMBLCHEMBL352459
IUPHARN/A
BindingDB50085692
DrugBankN/A

Structure

SDF download

2D structure
Lipinski's druglikenessThis ligand satisfies Lipinski's rule of five.

Experimental Data

ParameterValueReferenceDatabase source
Ki540.0 nMPMID10715143BindingDB,ChEMBL

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