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BDBM50127877 3-{3-[2-(2-Chloro-ethoxy)-ethoxy]-phenyl}-4,5-dihydro-isoxazole-5-carboxylic acid (2'-sulfamoyl-biphenyl-4-yl)-amide::CHEMBL300908

SMILES: NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(=NO2)c2cccc(OCCOCCCl)c2)cc1

InChI Key: InChIKey=AZOZFKHHDNWACV-UHFFFAOYSA-N

Data: 1 KI

Find this compound or compounds like it in BindingDB or PDB:
   Substructure
Similarity at least:  must be >=0.5
Exact match

Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50127877   
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
Coagulation factor X


(Homo sapiens (Human))
BDBM50127877
PNG
(3-{3-[2-(2-Chloro-ethoxy)-ethoxy]-phenyl}-4,5-dihy...)
Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(=NO2)c2cccc(OCCOCCCl)c2)cc1 |c:20|
Show InChI InChI=1S/C26H26ClN3O6S/c27-12-13-34-14-15-35-21-5-3-4-19(16-21)23-17-24(36-30-23)26(31)29-20-10-8-18(9-11-20)22-6-1-2-7-25(22)37(28,32)33/h1-11,16,24H,12-15,17H2,(H,29,31)(H2,28,32,33)
PDB
MMDB

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Similars

PubMed
1.50E+4n/an/an/an/an/an/an/an/a



Bristol-Myers Squibb Co.

Curated by ChEMBL


Assay Description
Binding affinity against the Factor Xa (FXa)


Bioorg Med Chem Lett 13: 1795-9 (2003)


BindingDB Entry DOI: 10.7270/Q2N29WBV
More data for this
Ligand-Target Pair