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Assay Detail

CHEMBL812840

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Binding
Binding affinity was determined against human 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 Autocuration

Target

Prothrombin (CHEMBL204)
Type SINGLE PROTEIN
Organism Homo sapiens

Publication

Estimation of binding affinities for selective thrombin inhibitors via Monte Carlo simulations.
Pierce AC, Jorgensen WL.
J Med Chem (2001) 44 : 1043 -1050
PubMed 11297451 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 11 8.67 10.35

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL9582 1 10.35
CHEMBL267676 1 10.00
CHEMBL9463 1 9.92
CHEMBL9664 1 9.52
CHEMBL269206 1 9.42
CHEMBL1159708 1 8.48
CHEMBL9496 1 8.42
CHEMBL9507 1 8.10
CHEMBL9461 1 7.96
CHEMBL273645 1 7.74
CHEMBL9293 1 5.48

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL9582 Ki = 0.045 nM 10.35
CHEMBL267676 Ki = 0.1 nM 10.00
CHEMBL9463 Ki = 0.12 nM 9.92
CHEMBL9664 Ki = 0.3 nM 9.52
CHEMBL269206 Ki = 0.38 nM 9.42
CHEMBL1159708 Ki = 3.3 nM 8.48
CHEMBL9496 Ki = 3.8 nM 8.42
CHEMBL9507 Ki = 8.0 nM 8.10
CHEMBL9461 Ki = 11.0 nM 7.96
CHEMBL273645 Ki = 18.4 nM 7.74
CHEMBL9293 Ki = 3300.0 nM 5.48