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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 = 'BDBM50324791'   
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))
BDBM50324791
PNG
(CHEMBL1221488)
Show SMILES CS(=O)(=O)N1C[C@@H]([C@H](C1)C(=O)Nc1ccc(cc1)N1CCCCS1(=O)=O)C(=O)Nc1ccc(Cl)cc1 |r|
Show InChI InChI=1S/C23H27ClN4O6S2/c1-35(31,32)27-14-20(22(29)25-17-6-4-16(24)5-7-17)21(15-27)23(30)26-18-8-10-19(11-9-18)28-12-2-3-13-36(28,33)34/h4-11,20-21H,2-3,12-15H2,1H3,(H,25,29)(H,26,30)/t20-,21-/m0/s1
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PC cid
PC sid
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Article
PubMed
201n/an/an/an/an/an/an/an/a



F. Hoffmann-La Roche Ltd

Curated by ChEMBL


Assay Description
Binding affinity to factor 10a


Bioorg Med Chem Lett 20: 5313-9 (2010)


Article DOI: 10.1016/j.bmcl.2010.06.126
BindingDB Entry DOI: 10.7270/Q2542NSG
More data for this
Ligand-Target Pair