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PubMed code 26122211

Compile data set for download or QSAR
Found 3 hits of Enzyme Inhibition Constant Data   
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
Tryptase beta-2/delta/gamma


(Homo sapiens (Human))
BDBM50322033
PNG
(2-Methylisoindole-1,3-dione-5-yl 3-(6-aminopyridin...)
Show SMILES CN1C(=O)c2ccc(OC(=O)CCc3ccc(N)nc3)cc2C1=O
Show InChI InChI=1S/C17H15N3O4/c1-20-16(22)12-5-4-11(8-13(12)17(20)23)24-15(21)7-3-10-2-6-14(18)19-9-10/h2,4-6,8-9H,3,7H2,1H3,(H2,18,19)
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Article
PubMed
n/an/a 190n/an/an/an/an/an/a



Tokyo University of Pharmacy and Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of tryptase (unknown origin) using t-Boc-Phe-Ser-Arg-MCA as substrate after 5 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 3676-80 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.039
BindingDB Entry DOI: 10.7270/Q2416ZV8
More data for this
Ligand-Target Pair
Trypsin


(Homo sapiens (Human))
BDBM50322033
PNG
(2-Methylisoindole-1,3-dione-5-yl 3-(6-aminopyridin...)
Show SMILES CN1C(=O)c2ccc(OC(=O)CCc3ccc(N)nc3)cc2C1=O
Show InChI InChI=1S/C17H15N3O4/c1-20-16(22)12-5-4-11(8-13(12)17(20)23)24-15(21)7-3-10-2-6-14(18)19-9-10/h2,4-6,8-9H,3,7H2,1H3,(H2,18,19)
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Article
PubMed
n/an/a 1.20E+3n/an/an/an/an/an/a



Tokyo University of Pharmacy and Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of trypsin (unknown origin) using Bz-Arg-pNA.HCl as substrate after 5 mins by colorimetric analysis


Bioorg Med Chem Lett 25: 3676-80 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.039
BindingDB Entry DOI: 10.7270/Q2416ZV8
More data for this
Ligand-Target Pair
Prothrombin


(Homo sapiens (Human))
BDBM50322033
PNG
(2-Methylisoindole-1,3-dione-5-yl 3-(6-aminopyridin...)
Show SMILES CN1C(=O)c2ccc(OC(=O)CCc3ccc(N)nc3)cc2C1=O
Show InChI InChI=1S/C17H15N3O4/c1-20-16(22)12-5-4-11(8-13(12)17(20)23)24-15(21)7-3-10-2-6-14(18)19-9-10/h2,4-6,8-9H,3,7H2,1H3,(H2,18,19)
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Article
PubMed
n/an/a 5.30E+3n/an/an/an/an/an/a



Tokyo University of Pharmacy and Life Sciences

Curated by ChEMBL


Assay Description
Inhibition of thrombin (unknown origin) using t-Boc-Val-Pro-Arg-MCA as substrate after 5 mins by fluorimetric analysis


Bioorg Med Chem Lett 25: 3676-80 (2015)


Article DOI: 10.1016/j.bmcl.2015.06.039
BindingDB Entry DOI: 10.7270/Q2416ZV8
More data for this
Ligand-Target Pair
* indicates data uncertainty>20%