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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'B1 bradykinin receptor' and Ligand = 'BDBM50182458'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
B1 bradykinin receptor


(Homo sapiens (Human))
BDBM50182458
PNG
(CHEMBL201310 | methyl 4'-({[N-(3,3,3-trifluoroprop...)
Show SMILES COC(=O)c1ccccc1-c1ccc(CNC(=O)[C@@H](C)NC(=O)CC(F)(F)F)cc1
Show InChI InChI=1S/C21H21F3N2O4/c1-13(26-18(27)11-21(22,23)24)19(28)25-12-14-7-9-15(10-8-14)16-5-3-4-6-17(16)20(29)30-2/h3-10,13H,11-12H2,1-2H3,(H,25,28)(H,26,27)/t13-/m1/s1
PDB

KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem

Similars

Article
PubMed
1.58E+3n/an/an/an/an/an/an/an/a



TBA

Curated by ChEMBL


Assay Description
Binding affinity to human bradykinin B1 receptor expressed in CHO cells


J Med Chem 49: 1231-4 (2006)


Article DOI: 10.1021/jm0511280
BindingDB Entry DOI: 10.7270/Q2MW2GQ4
More data for this
Ligand-Target Pair