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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 = 'BDBM50114489'   
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))		BDBM50114489
PNG
(2-(3-Carbamimidoyl-phenoxy)-4-dimethylamino-N-(2'-...)
Show SMILES CN(C)c1ccc(C(=O)Nc2ccc(cc2)-c2ccccc2S(N)(=O)=O)c(Oc2cccc(c2)C(N)=N)c1
Show InChI InChI=1S/C28H27N5O4S/c1-33(2)21-14-15-24(25(17-21)37-22-7-5-6-19(16-22)27(29)30)28(34)32-20-12-10-18(11-13-20)23-8-3-4-9-26(23)38(31,35)36/h3-17H,1-2H3,(H3,29,30)(H,32,34)(H2,31,35,36)
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n/an/a 16n/an/an/an/an/an/a



Millennium Pharmaceuticals, Inc.

Curated by ChEMBL


Assay Description
Tested in vitro for the inhibitory activity against Coagulation factor Xa

Bioorg Med Chem Lett 12: 1657-61 (2002)


BindingDB Entry DOI: 10.7270/Q2R49Q2T
More data for this
Ligand-Target Pair