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GPCR

NameB2 bradykinin receptor
SpeciesCavia porcellus (Guinea pig)
GeneBDKRB2
SynonymB2R
BK-2 receptor
DiseaseN/A for non-human GPCRs
Length372
Amino acid sequenceMFNITSQVSALNATLAQGNSCLDAEWWSWLNTIQAPFLWVLFVLAVLENIFVLSVFFLHKSSCTVAEIYLGNLAVADLILAFGLPFWAITIANNFDWLFGEVLCRMVNTMIQMNMYSSICFLMLVSIDRYLALVKTMSMGRMRGVRWAKLYSLVIWGCALLLSSPMLVFRTMKDYRDEGHNVTACLIIYPSLTWQVFTNVLLNLVGFLLPLSIITFCTVQIMQVLRNNEMQKFKEIQTERRATVLVLAVLLLFVVCWLPFQIGTFLDTLRLLGFLPGCWEHVIDLITQISSYLAYSNSCLNPLVYVIVGKRFRKKSREVYHGLCRSGGCVSEPAQSENSMGTLRTSISVDRQIHKLQDWARSSSEGTPPGLL
UniProtO70526
Protein Data BankN/A
GPCR-HGmod modelN/A
3D structure modelNo available structures or models
BioLiPN/A
Therapeutic Target DatabaseN/A
ChEMBLCHEMBL4111
IUPHARN/A
DrugBankN/A

Ligand

NameCHEMBL358232
Molecular formulaC25H23N3O
IUPAC name1-ethyl-5-methyl-2-[4-[(2-methylquinolin-4-yl)oxymethyl]phenyl]pyrrole-3-carbonitrile
Molecular weight381.479
Hydrogen bond acceptor3
Hydrogen bond donor0
XlogP4.9
SynonymsSCHEMBL7579266
BDBM50062904
1-Ethyl-5-methyl-2-[4-(2-methyl-quinolin-4-yloxymethyl)-phenyl]-1H-pyrrole-3-carbonitrile
Inchi KeyDYFGHBMXWLTOPT-UHFFFAOYSA-N
Inchi IDInChI=1S/C25H23N3O/c1-4-28-18(3)14-21(15-26)25(28)20-11-9-19(10-12-20)16-29-24-13-17(2)27-23-8-6-5-7-22(23)24/h5-14H,4,16H2,1-3H3
PubChem CID44369201
ChEMBLCHEMBL358232
IUPHARN/A
BindingDB50062904
DrugBankN/A

Structure

SDF download

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

Experimental Data

ParameterValueReferenceDatabase source
IC5031000.0 nMPMID9484506BindingDB,ChEMBL

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