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BDBM50210101 6-(3-chloro-5-fluoro-2-methoxybenzyl)-4-(4-chlorophenylsulfonyl)-1,4-diazepane-2,5-dione::CHEMBL247583

SMILES: COc1c(Cl)cc(F)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1

InChI Key: InChIKey=PNLZTVHNBZIXJW-UHFFFAOYSA-N

Data: 1 IC50

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   Substructure
Similarity at least:  must be >=0.5
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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50210101   
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))
BDBM50210101
PNG
(6-(3-chloro-5-fluoro-2-methoxybenzyl)-4-(4-chlorop...)
Show SMILES COc1c(Cl)cc(F)cc1CC1CNC(=O)CN(C1=O)S(=O)(=O)c1ccc(Cl)cc1
Show InChI InChI=1S/C19H17Cl2FN2O5S/c1-29-18-11(7-14(22)8-16(18)21)6-12-9-23-17(25)10-24(19(12)26)30(27,28)15-4-2-13(20)3-5-15/h2-5,7-8,12H,6,9-10H2,1H3,(H,23,25)
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MMDB

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Similars

Article
PubMed
n/an/a 4.20E+3n/an/an/an/an/an/a



Daiichi Asubio Pharma Co., Ltd

Curated by ChEMBL


Assay Description
Inhibition of human recombinant chymase


Bioorg Med Chem Lett 17: 3431-4 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.038
BindingDB Entry DOI: 10.7270/Q2G160H9
More data for this
Ligand-Target Pair