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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 = 'BDBM50537839'   
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))		BDBM50537839
PNG
(CHEMBL4642705)
Show SMILES [H][C@@]12CC[C@@]3(C)C[C@@]1(C\C3=N/NC(=S)Nc1ccc(cc1)C#N)CC[C@]1([H])[C@@](C)(CCC[C@@]21C)C(=O)OCC |r,THB:10:9:1.3.2:6|
Show InChI InChI=1S/C30H40N4O2S/c1-5-36-25(35)29(4)14-6-13-28(3)22(29)12-16-30-17-24(27(2,19-30)15-11-23(28)30)33-34-26(37)32-21-9-7-20(18-31)8-10-21/h7-10,22-23H,5-6,11-17,19H2,1-4H3,(H2,32,34,37)/b33-24+/t22-,23-,27-,28+,29+,30-/m0/s1
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n/an/a 1.36E+4n/an/an/an/an/an/a



Peking University

Curated by ChEMBL


Assay Description
Inhibition of factor 10a (unknown origin)

Bioorg Med Chem Lett 30: (2020)


Article DOI: 10.1016/j.bmcl.2019.07.044
BindingDB Entry DOI: 10.7270/Q2R49V9M
More data for this
Ligand-Target Pair