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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 = 'BDBM50435624'   
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))
BDBM50435624
PNG
(CHEMBL2391187)
Show SMILES CC1(CCCN(C1=O)c1ccc(cc1)N1C[C@H](CNC(=O)c2cnc(N)s2)OC1=O)C(O)=O |r|
Show InChI InChI=1S/C21H23N5O6S/c1-21(18(29)30)7-2-8-25(17(21)28)12-3-5-13(6-4-12)26-11-14(32-20(26)31)9-23-16(27)15-10-24-19(22)33-15/h3-6,10,14H,2,7-9,11H2,1H3,(H2,22,24)(H,23,27)(H,29,30)/t14-,21?/m0/s1
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Similars

Article
PubMed
1.12E+4n/an/an/an/an/an/an/an/a



University of Ljubljana

Curated by ChEMBL


Assay Description
Inhibition of F10a (unknown origin) using S-2222 as substrate incubated for 15 mins prior to substrate addition measured every 10 secs by spectrophot...


Eur J Med Chem 64: 302-13 (2013)


Article DOI: 10.1016/j.ejmech.2013.03.056
BindingDB Entry DOI: 10.7270/Q2Q241N8
More data for this
Ligand-Target Pair