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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 = 'BDBM50211560'   
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))
BDBM50211560
PNG
(CHEMBL231292 | N-[(2-aminomethyl-5-chloro-benzylca...)
Show SMILES CCCS(=O)(=O)NC(CCc1cccc[n+]1[O-])C(=O)NCC(=O)NCc1cc(Cl)ccc1CN |w:7.7|
Show InChI InChI=1S/C22H30ClN5O5S/c1-2-11-34(32,33)27-20(9-8-19-5-3-4-10-28(19)31)22(30)26-15-21(29)25-14-17-12-18(23)7-6-16(17)13-24/h3-7,10,12,20,27H,2,8-9,11,13-15,24H2,1H3,(H,25,29)(H,26,30)
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MMDB

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Similars

Article
PubMed
3.40n/an/an/an/an/an/an/an/a



Curacyte Discovery GmbH

Curated by ChEMBL


Assay Description
Inhibition of factor 10a


Bioorg Med Chem Lett 17: 3322-9 (2007)


Article DOI: 10.1016/j.bmcl.2007.03.105
BindingDB Entry DOI: 10.7270/Q2NG4Q9K
More data for this
Ligand-Target Pair