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BDBM50127902 3-(4-Hydroxy-phenyl)-4,5-dihydro-isoxazole-5-carboxylic acid (2'-sulfamoyl-biphenyl-4-yl)-amide::CHEMBL298891

SMILES: NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(=NO2)c2ccc(O)cc2)cc1

InChI Key: InChIKey=QJMJIMCIHCYGLU-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 = 50127902   
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))
BDBM50127902
PNG
(3-(4-Hydroxy-phenyl)-4,5-dihydro-isoxazole-5-carbo...)
Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(=NO2)c2ccc(O)cc2)cc1 |c:20|
Show InChI InChI=1S/C22H19N3O5S/c23-31(28,29)21-4-2-1-3-18(21)14-5-9-16(10-6-14)24-22(27)20-13-19(25-30-20)15-7-11-17(26)12-8-15/h1-12,20,26H,13H2,(H,24,27)(H2,23,28,29)
PDB
MMDB

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Similars

PubMed
2.20E+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