Skip to main content
Free research Free research Free assay review with research home and workspace preview
Quick search ChEMBL 36
Assay Detail

CHEMBL882279

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

Binding
In vitro inhibitory activity against serine protease thrombin
ChEMBL ↗
45
Total Activities
45
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

Design, synthesis, and structure-activity relationships of unsubstituted piperazinone-based transition state factor Xa inhibitors.
Huang W, Naughton MA, Yang H, Su T, Dam S, Wong PW, Arfsten A, Edwards S, Sinha U, Hollenbach S, Scarborough RM, Zhu BY.
Bioorg Med Chem Lett (2003) 13 : 723 -728
PubMed 12639567 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 45 5.86 8.10

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL351735 — — 1 8.10
CHEMBL350629 — — 1 7.42
CHEMBL163799 — — 1 6.93
CHEMBL162669 — — 1 6.87
CHEMBL350650 — — 1 6.86
CHEMBL349290 — — 1 6.73
CHEMBL163213 — — 1 6.57
CHEMBL445385 — — 1 6.43
CHEMBL162461 — — 1 6.41
CHEMBL262186 — — 1 6.38
CHEMBL355376 — — 1 6.25
CHEMBL163401 — — 1 6.24
CHEMBL423421 — — 1 6.17
CHEMBL423284 — — 1 6.14
CHEMBL166258 — — 1 6.12
CHEMBL423810 — — 1 6.12
CHEMBL406940 — — 1 6.10
CHEMBL164426 — — 1 6.09
CHEMBL159734 — — 1 6.06
CHEMBL162457 — — 1 6.00
CHEMBL159695 — — 1 6.00
CHEMBL161881 — — 1 5.70
CHEMBL350587 — — 1 5.70
CHEMBL423281 — — 1 5.70
CHEMBL163809 — — 1 5.52
CHEMBL164481 — — 1 5.52
CHEMBL163121 — — 1 5.40
CHEMBL162237 — — 1 5.40
CHEMBL159716 — — 1 5.40
CHEMBL351180 — — 1 5.40

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL351735 — IC50 = 8.0 nM 8.10
CHEMBL350629 — IC50 = 38.0 nM 7.42
CHEMBL163799 — IC50 = 118.0 nM 6.93
CHEMBL162669 — IC50 = 134.0 nM 6.87
CHEMBL350650 — IC50 = 138.0 nM 6.86
CHEMBL349290 — IC50 = 185.0 nM 6.73
CHEMBL163213 — IC50 = 267.0 nM 6.57
CHEMBL445385 — IC50 = 375.0 nM 6.43
CHEMBL162461 — IC50 = 390.0 nM 6.41
CHEMBL262186 — IC50 = 417.0 nM 6.38
CHEMBL355376 — IC50 = 569.0 nM 6.25
CHEMBL163401 — IC50 = 573.0 nM 6.24
CHEMBL423421 — IC50 = 669.0 nM 6.17
CHEMBL423284 — IC50 = 719.0 nM 6.14
CHEMBL423810 — IC50 = 751.0 nM 6.12
CHEMBL166258 — IC50 = 751.0 nM 6.12
CHEMBL406940 — IC50 = 792.0 nM 6.10
CHEMBL164426 — IC50 = 809.0 nM 6.09
CHEMBL159734 — IC50 = 870.0 nM 6.06
CHEMBL162457 — IC50 = 1000.0 nM 6.00
CHEMBL159695 — IC50 = 1000.0 nM 6.00
CHEMBL423281 — IC50 = 2000.0 nM 5.70
CHEMBL350587 — IC50 = 2000.0 nM 5.70
CHEMBL161881 — IC50 = 2000.0 nM 5.70
CHEMBL163809 — IC50 = 3000.0 nM 5.52
CHEMBL164481 — IC50 = 3000.0 nM 5.52
CHEMBL163121 — IC50 = 4000.0 nM 5.40
CHEMBL162237 — IC50 = 4000.0 nM 5.40
CHEMBL159716 — IC50 = 4000.0 nM 5.40
CHEMBL351180 — IC50 = 4000.0 nM 5.40
CHEMBL349745 — IC50 = 5000.0 nM 5.30
CHEMBL163588 — IC50 = 5000.0 nM 5.30
CHEMBL163062 — IC50 = 5000.0 nM 5.30
CHEMBL163174 — IC50 = 6000.0 nM 5.22
CHEMBL163437 — IC50 = 6000.0 nM 5.22
CHEMBL265997 — IC50 = 7000.0 nM 5.16
CHEMBL349629 — IC50 = 7000.0 nM 5.16
CHEMBL162726 — IC50 = 7000.0 nM 5.16
CHEMBL352039 — IC50 = 10000.0 nM 5.00
CHEMBL162909 — IC50 = 11000.0 nM 4.96
CHEMBL166317 — IC50 = 12000.0 nM 4.92
CHEMBL162160 — IC50 = 14000.0 nM 4.85
CHEMBL162839 — IC50 = 17000.0 nM 4.77
CHEMBL351982 — IC50 > 500000.0 nM -
CHEMBL351052 — IC50 = 220000.0 nM -