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BDBM50208226 (E)-1-(5-chlorobenzo[b]thiophen-3-yl)-2-oxo-2-(styrylamino)ethylphosphonic acid::CHEMBL223303

SMILES: OP(O)(=O)C(C(=O)NC=Cc1ccccc1)c1csc2ccc(Cl)cc12

InChI Key: InChIKey=MNUNMFWGEVHZSR-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50208226   
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
Chymase


(Homo sapiens (Human))
BDBM50208226
PNG
((E)-1-(5-chlorobenzo[b]thiophen-3-yl)-2-oxo-2-(sty...)
Show SMILES OP(O)(=O)C(C(=O)NC=Cc1ccccc1)c1csc2ccc(Cl)cc12 |w:9.9|
Show InChI InChI=1S/C18H15ClNO4PS/c19-13-6-7-16-14(10-13)15(11-26-16)17(25(22,23)24)18(21)20-9-8-12-4-2-1-3-5-12/h1-11,17H,(H,20,21)(H2,22,23,24)
PDB
MMDB

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Article
PubMed
n/an/a 60n/an/an/an/an/an/a



Johnson & Johnson Pharmaceutical Research and Development

Curated by ChEMBL


Assay Description
Inhibition of human skin chymase


J Med Chem 50: 1727-30 (2007)


Article DOI: 10.1021/jm0700619
BindingDB Entry DOI: 10.7270/Q26W99RF
More data for this
Ligand-Target Pair