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Assay Detail

CHEMBL3385909

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

Binding
Inhibition of bovine thrombin assessed as reduction in hydrolysis of chromogenic substrate S-2238 by Cheng-Prusoff equation analysis
6
Total Activities
6
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Bos taurus
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Prothrombin (CHEMBL4471)
Type SINGLE PROTEIN
Organism Bos taurus

Publication

How a β-D-glucoside side chain enhances binding affinity to thrombin of inhibitors bearing 2-chlorothiophene as P1 moiety: crystallography, fragment deconstruction study, and evaluation of antithrombotic properties.
Belviso BD, Caliandro R, de Candia M, Zaetta G, Lopopolo G, Incampo F, Colucci M, Altomare CD.
J Med Chem (2014) 57 : 8563 -8575
PubMed 25268757 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 6 5.56 7.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3343301 1 7.00
CHEMBL3343300 1 6.80
CHEMBL3343299 1 4.96
CHEMBL3343303 1 4.53
CHEMBL3343302 1 4.51
CHEMBL3343304 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3343301 Ki = 100.0 nM 7.00
CHEMBL3343300 Ki = 160.0 nM 6.80
CHEMBL3343299 Ki = 11000.0 nM 4.96
CHEMBL3343303 Ki = 29800.0 nM 4.53
CHEMBL3343302 Ki = 31000.0 nM 4.51
CHEMBL3343304 Ki = 133000.0 nM -