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BDBM50317094 2-(1-{(2S)-3-[(6-Chloronaphthalen-2-yl)sulfonyl]-2-hydroxypropanoyl}piperidin-4-yl)tetrahydropyridazin-3(2H)-one::CHEMBL1096792

SMILES: O[C@H](CS(=O)(=O)c1ccc2cc(Cl)ccc2c1)C(=O)N1CCC(CC1)N1NCCCC1=O

InChI Key: InChIKey=IBJWVKWLASDSST-HXUWFJFHSA-N

Data: 1 IC50

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Activity Spreadsheet -- Enzyme Inhibition Constant Data from BindingDB

Found 1 hit for monomerid = 50317094   
Target/Host
(Institution)
LigandTarget/Host
Links
Ligand
Links
Trg + Lig
Links
Ki
nM
ΔG°
kcal/mole
IC50
nM
Kd
nM
EC50/IC50
nM
koff
s-1
kon
M-1s-1
pHTemp
°C
Coagulation factor X


(Homo sapiens (Human))
BDBM50317094
PNG
(2-(1-{(2S)-3-[(6-Chloronaphthalen-2-yl)sulfonyl]-2...)
Show SMILES O[C@H](CS(=O)(=O)c1ccc2cc(Cl)ccc2c1)C(=O)N1CCC(CC1)N1NCCCC1=O |r|
Show InChI InChI=1S/C22H26ClN3O5S/c23-17-5-3-16-13-19(6-4-15(16)12-17)32(30,31)14-20(27)22(29)25-10-7-18(8-11-25)26-21(28)2-1-9-24-26/h3-6,12-13,18,20,24,27H,1-2,7-11,14H2/t20-/m1/s1
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Article
PubMed
n/an/a 49n/an/an/an/an/an/a



Takeda Pharmaceutical Company Ltd.

Curated by ChEMBL


Assay Description
Inhibition of human factor 10a assessed as p-nitroanilide release using S2765 as substrate by chromogenic assay


J Med Chem 53: 3517-31 (2010)


Article DOI: 10.1021/jm901699j
BindingDB Entry DOI: 10.7270/Q2PR7W52
More data for this
Ligand-Target Pair