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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 = 'BDBM50537844'   
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))
BDBM50537844
PNG
(CHEMBL4643136)
Show SMILES CN(C)C(=O)[C@@H]1CC[C@@H](NC(=O)c2nc3CCN(C)Cc3s2)[C@H](C1)NC(=O)C(=O)Nc1ccc(Cl)cn1 |r|
Show InChI InChI=1S/C24H30ClN7O4S/c1-31(2)24(36)13-4-6-15(27-22(35)23-29-16-8-9-32(3)12-18(16)37-23)17(10-13)28-20(33)21(34)30-19-7-5-14(25)11-26-19/h5,7,11,13,15,17H,4,6,8-10,12H2,1-3H3,(H,27,35)(H,28,33)(H,26,30,34)/t13-,15-,17+/m1/s1
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PC cid
PC sid
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Article
PubMed
n/an/a 3.40n/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