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Assay Detail

CHEMBL5729938

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Binding
Enzyme Assay: The inhibition constants for human plasmin (h plasmin), human plasma kallikrein (h PK), thrombin and factor Xa were determined in analogy to a previously disclosed method (Stürzebecher et al., J. Med. Chem., 40, 3091-3099 (1997)), using a microplate reader (Multiscan Ascent, Thermo Scientific) at 405 nm. The reactions to determine the inhibition of human plasmin and human plasma kallikrein were carried out at 25° C. in 200 μl 50 mM Tris×HCl buffer pH 8.0 (containing 0.154 M NaCl, 2% ethanol and inhibitor in appropriate concentrations) and 25 μl substrate solution. Reactions were started by addition of 50 μl of enzyme solution.
45
Total Activities
15
Compounds Tested
3
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Autocuration

Target

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Serine protease inhibitors
(2014)

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 15 6.25 8.04
kon 15 - -
k_off 15 - -

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2016869 3 8.04
CHEMBL2016870 3 7.57
CHEMBL2016868 3 7.34
CHEMBL3666823 3 7.00
CHEMBL3666824 3 6.73
CHEMBL3666826 3 6.66
CHEMBL2016872 3 6.29
CHEMBL3666822 3 6.24
CHEMBL2016866 3 5.70
CHEMBL2016867 3 5.67
CHEMBL3666821 3 5.52
CHEMBL2016873 3 5.37
CHEMBL2016874 3 5.34
CHEMBL2016864 3 5.19
CHEMBL3666825 3 5.08

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2016869 Ki = 9.1 nM 8.04
CHEMBL2016870 Ki = 26.8 nM 7.57
CHEMBL2016868 Ki = 45.4 nM 7.34
CHEMBL3666823 Ki = 100.0 nM 7.00
CHEMBL3666824 Ki = 187.0 nM 6.73
CHEMBL3666826 Ki = 219.0 nM 6.66
CHEMBL2016872 Ki = 510.0 nM 6.29
CHEMBL3666822 Ki = 575.0 nM 6.24
CHEMBL2016866 Ki = 2020.0 nM 5.70
CHEMBL2016867 Ki = 2119.0 nM 5.67
CHEMBL3666821 Ki = 3000.0 nM 5.52
CHEMBL2016873 Ki = 4300.0 nM 5.37
CHEMBL2016874 Ki = 4560.0 nM 5.34
CHEMBL2016864 Ki = 6520.0 nM 5.19
CHEMBL3666825 Ki = 8400.0 nM 5.08
CHEMBL2016873 k_off = - s-1 -
CHEMBL2016874 kon = - -
CHEMBL2016874 k_off = - s-1 -
CHEMBL3666821 kon = - -
CHEMBL3666821 k_off = - s-1 -
CHEMBL2016864 kon = - -
CHEMBL2016864 k_off = - s-1 -
CHEMBL2016867 k_off = - s-1 -
CHEMBL2016870 k_off = - s-1 -
CHEMBL2016868 kon = - -
CHEMBL2016868 k_off = - s-1 -
CHEMBL3666822 kon = - -
CHEMBL3666822 k_off = - s-1 -
CHEMBL2016869 k_off = - s-1 -
CHEMBL2016867 kon = - -
CHEMBL2016873 kon = - -
CHEMBL2016870 kon = - -
CHEMBL3666825 k_off = - s-1 -
CHEMBL3666825 kon = - -
CHEMBL3666826 k_off = - s-1 -
CHEMBL3666826 kon = - -
CHEMBL2016866 k_off = - s-1 -
CHEMBL2016866 kon = - -
CHEMBL2016869 kon = - -
CHEMBL3666824 kon = - -
CHEMBL2016872 k_off = - s-1 -
CHEMBL3666824 k_off = - s-1 -
CHEMBL3666823 kon = - -
CHEMBL2016872 kon = - -
CHEMBL3666823 k_off = - s-1 -