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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 = 'BDBM50149100'   
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))
BDBM50149100
PNG
(3-[2-(5-Chloro-thiophen-2-yl)-1H-benzoimidazol-5-y...)
Show SMILES Clc1ccc(s1)-c1nc2ccc(CCC(=O)Nc3ccc(cc3)N3CCOCC3=O)cc2[nH]1
Show InChI InChI=1S/C24H21ClN4O3S/c25-21-9-8-20(33-21)24-27-18-7-1-15(13-19(18)28-24)2-10-22(30)26-16-3-5-17(6-4-16)29-11-12-32-14-23(29)31/h1,3-9,13H,2,10-12,14H2,(H,26,30)(H,27,28)
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n/an/a 10n/an/an/an/an/an/a



Merck KGaA

Curated by ChEMBL


Assay Description
Binding affinity of the compoumd to human coagulation factor Xa


Bioorg Med Chem Lett 14: 3763-9 (2004)


Article DOI: 10.1016/j.bmcl.2004.04.097
BindingDB Entry DOI: 10.7270/Q25H7FQS
More data for this
Ligand-Target Pair