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Assay Detail

CHEMBL814972

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Binding
Inhibitory constant evaluated against thrombin (Factor IIa)
23
Total Activities
23
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

Unexpected enhancement of thrombin inhibitor potency with o-aminoalkylbenzylamides in the P1 position.
Rittle KE, Barrow JC, Cutrona KJ, Glass KL, Krueger JA, Kuo LC, Lewis SD, Lucas BJ, McMasters DR, Morrissette MM, Nantermet PG, Newton CL, Sanders WM, Yan Y, Vacca JP, Selnick HG.
Bioorg Med Chem Lett (2003) 13 : 3477 -3482
PubMed 14505652 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 23 8.02 10.34

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL420682 1 10.34
CHEMBL116202 1 10.30
CHEMBL116258 1 9.89
CHEMBL11157 L-374087 1 9.30
CHEMBL287614 1 9.30
CHEMBL19080 L-375378 1 9.10
CHEMBL117098 1 8.48
CHEMBL119820 1 8.48
CHEMBL117387 1 8.39
CHEMBL115643 1 8.34
CHEMBL116015 1 8.28
CHEMBL334257 1 8.18
CHEMBL296041 1 8.15
CHEMBL332934 1 7.41
CHEMBL115755 1 7.31
CHEMBL118077 1 7.21
CHEMBL117365 1 6.89
CHEMBL321130 1 6.60
CHEMBL324349 1 6.50
CHEMBL119779 1 6.33
CHEMBL117147 1 6.31
CHEMBL116597 1 5.34
CHEMBL419773 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL420682 Ki = 0.046 nM 10.34
CHEMBL116202 Ki = 0.05 nM 10.30
CHEMBL116258 Ki = 0.13 nM 9.89
CHEMBL11157 L-374087 Ki = 0.5 nM 9.30
CHEMBL287614 Ki = 0.5 nM 9.30
CHEMBL19080 L-375378 Ki = 0.8 nM 9.10
CHEMBL117098 Ki = 3.3 nM 8.48
CHEMBL119820 Ki = 3.3 nM 8.48
CHEMBL117387 Ki = 4.1 nM 8.39
CHEMBL115643 Ki = 4.6 nM 8.34
CHEMBL116015 Ki = 5.2 nM 8.28
CHEMBL334257 Ki = 6.6 nM 8.18
CHEMBL296041 Ki = 7.1 nM 8.15
CHEMBL332934 Ki = 39.0 nM 7.41
CHEMBL115755 Ki = 49.0 nM 7.31
CHEMBL118077 Ki = 62.0 nM 7.21
CHEMBL117365 Ki = 130.0 nM 6.89
CHEMBL321130 Ki = 250.0 nM 6.60
CHEMBL324349 Ki = 313.0 nM 6.50
CHEMBL119779 Ki = 470.0 nM 6.33
CHEMBL117147 Ki = 490.0 nM 6.31
CHEMBL116597 Ki = 4600.0 nM 5.34
CHEMBL419773 Ki = 0.0034 nM -