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Compile Data Set for Download or QSAR

Found 1 hit Enz. Inhib. hit(s) with Target = 'Coagulation factor X' and Ligand = 'BDBM50127870'   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kJ/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50127870
PNG
(3-Phenethyl-4,5-dihydro-isoxazole-5-carboxylic aci...)
Show SMILES NS(=O)(=O)c1ccccc1-c1ccc(NC(=O)C2CC(CCc3ccccc3)=NO2)cc1 |c:29|
Show InChI InChI=1S/C24H23N3O4S/c25-32(29,30)23-9-5-4-8-21(23)18-11-14-19(15-12-18)26-24(28)22-16-20(27-31-22)13-10-17-6-2-1-3-7-17/h1-9,11-12,14-15,22H,10,13,16H2,(H,26,28)(H2,25,29,30)
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MMDB

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Similars

PubMed
>3.00E+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