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Assay Detail

CHEMBL870018

Review assay metadata, readout intent, target linkage, and publication context from the same page.

Binding
Inhibition of thrombin by chromogenic assay
25
Total Activities
25
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Homo sapiens
Confidence 9 — Direct single protein target
Curated By Expert

Target

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Orally active thrombin inhibitors. Part 2: optimization of the P2-moiety.
Lange UE, Baucke D, Hornberger W, Mack H, Seitz W, Höffken HW.
Bioorg Med Chem Lett (2006) 16 : 2648 -2653
PubMed 16460939 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 7.49 9.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL377303 1 9.00
CHEMBL208140 1 9.00
CHEMBL206418 1 8.77
CHEMBL3559601 1 8.77
CHEMBL377681 1 8.74
CHEMBL207187 1 8.57
CHEMBL206891 1 8.49
CHEMBL208055 1 8.47
CHEMBL383314 1 7.83
CHEMBL377132 1 7.80
CHEMBL208262 1 7.70
CHEMBL208474 1 7.50
CHEMBL205766 1 7.36
CHEMBL207788 1 7.33
CHEMBL377056 1 7.25
CHEMBL379920 1 7.23
CHEMBL266349 MELAGATRAN 4.0 1 7.16
CHEMBL207836 1 7.15
CHEMBL208190 1 7.12
CHEMBL208137 1 6.99
CHEMBL208306 1 6.54
CHEMBL207603 1 6.54
CHEMBL204468 1 6.24
CHEMBL207564 1 5.39
CHEMBL378185 1 4.27

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL377303 IC50 = 1.0 nM 9.00
CHEMBL208140 IC50 = 1.0 nM 9.00
CHEMBL206418 IC50 = 1.7 nM 8.77
CHEMBL3559601 IC50 = 1.7 nM 8.77
CHEMBL377681 IC50 = 1.8 nM 8.74
CHEMBL207187 IC50 = 2.7 nM 8.57
CHEMBL206891 IC50 = 3.2 nM 8.49
CHEMBL208055 IC50 = 3.4 nM 8.47
CHEMBL383314 IC50 = 14.8 nM 7.83
CHEMBL377132 IC50 = 16.0 nM 7.80
CHEMBL208262 IC50 = 20.2 nM 7.70
CHEMBL208474 IC50 = 31.9 nM 7.50
CHEMBL205766 IC50 = 44.2 nM 7.36
CHEMBL207788 IC50 = 47.3 nM 7.33
CHEMBL377056 IC50 = 56.3 nM 7.25
CHEMBL379920 IC50 = 58.4 nM 7.23
CHEMBL266349 MELAGATRAN IC50 = 69.2 nM 7.16
CHEMBL207836 IC50 = 71.2 nM 7.15
CHEMBL208190 IC50 = 76.8 nM 7.12
CHEMBL208137 IC50 = 103.0 nM 6.99
CHEMBL208306 IC50 = 290.0 nM 6.54
CHEMBL207603 IC50 = 288.0 nM 6.54
CHEMBL204468 IC50 = 581.0 nM 6.24
CHEMBL207564 IC50 = 4090.0 nM 5.39
CHEMBL378185 IC50 = 53600.0 nM 4.27