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Assay Detail

CHEMBL873984

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Binding
Inhibition of thrombin
11
Total Activities
11
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

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

Target

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

The design of potent and selective inhibitors of thrombin utilizing a piperazinedione template: part 2.
Cody WL, Augelli-Szafran CE, Berryman KA, Cai C, Doherty AM, Edmunds JJ, He JX, Narasimhan LS, Penvose-Yi J, Plummer JS, Rapundalo ST, Rubin JR, Van Huis CA, Leblond L, Winocour PD, Siddiqui MA.
Bioorg Med Chem Lett (1999) 9 : 2503 -2508
PubMed 10498197 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 11 7.50 8.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL83260 1 8.92
CHEMBL79245 1 8.46
CHEMBL313769 1 8.10
CHEMBL84084 1 7.70
CHEMBL309298 1 7.50
CHEMBL408553 1 7.26
CHEMBL404654 1 7.26
CHEMBL310722 1 7.26
CHEMBL83001 1 7.10
CHEMBL82753 1 6.89
CHEMBL83437 1 6.08

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL83260 Ki = 1.2 nM 8.92
CHEMBL79245 Ki = 3.5 nM 8.46
CHEMBL313769 Ki = 8.0 nM 8.10
CHEMBL84084 Ki = 20.0 nM 7.70
CHEMBL309298 Ki = 32.0 nM 7.50
CHEMBL408553 Ki = 55.0 nM 7.26
CHEMBL404654 Ki = 55.0 nM 7.26
CHEMBL310722 Ki = 55.0 nM 7.26
CHEMBL83001 Ki = 80.0 nM 7.10
CHEMBL82753 Ki = 130.0 nM 6.89
CHEMBL83437 Ki = 825.0 nM 6.08