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BDBM50184191 3,3'-difluoro-4'-[(5-morpholin-4-ylmethyl-pyridin-2-ylamino)-methyl]-biphenyl-2-carboxylic acid methyl ester::CHEMBL207922

SMILES: COC(=O)c1c(F)cccc1-c1ccc(CNc2ccc(CN3CCOCC3)cn2)c(F)c1

InChI Key: InChIKey=FVEYEMQPBNRYQF-UHFFFAOYSA-N

Data: 1 KI

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50184191   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Bradykinin B1 receptor


(Homo sapiens (Human))
BDBM50184191
PNG
(3,3'-difluoro-4'-[(5-morpholin-4-ylmethyl-pyridin-...)
Show SMILES COC(=O)c1c(F)cccc1-c1ccc(CNc2ccc(CN3CCOCC3)cn2)c(F)c1
Show InChI InChI=1S/C25H25F2N3O3/c1-32-25(31)24-20(3-2-4-21(24)26)18-6-7-19(22(27)13-18)15-29-23-8-5-17(14-28-23)16-30-9-11-33-12-10-30/h2-8,13-14H,9-12,15-16H2,1H3,(H,28,29)
KEGG

UniProtKB/SwissProt

antibodypedia
GoogleScholar
AffyNet 
CHEMBL
PC cid
PC sid
UniChem
Article
PubMed
184n/an/an/an/an/an/an/an/a



Merck Research Laboratories

Curated by ChEMBL


Assay Description
Binding affinity to human BK1 receptor


Bioorg Med Chem Lett 16: 2791-5 (2006)


Article DOI: 10.1016/j.bmcl.2006.01.112
BindingDB Entry DOI: 10.7270/Q28915GX
More data for this
Ligand-Target Pair