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Assay Detail

CHEMBL1035201

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

Binding
Inhibition of trypsin
45
Total Activities
45
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Design, parallel synthesis, and crystal structures of biphenyl antithrombotics as selective inhibitors of tissue factor FVIIa complex. Part 1: Exploration of S2 pocket pharmacophores.
Kotian PL, Krishnan R, Rowland S, El-Kattan Y, Saini SK, Upshaw R, Bantia S, Arnold S, Babu YS, Chand P.
Bioorg Med Chem (2009) 17 : 3934 -3958
PubMed 19409795 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 45 8.93 9.77

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL224485 1 9.77
CHEMBL505189 1 9.62
CHEMBL505455 1 9.43
CHEMBL505190 1 9.42
CHEMBL519886 1 9.41
CHEMBL501749 1 9.40
CHEMBL527118 1 9.39
CHEMBL525274 1 9.38
CHEMBL506772 1 9.37
CHEMBL485704 1 9.33
CHEMBL506771 1 9.33
CHEMBL502293 1 9.29
CHEMBL520364 1 9.28
CHEMBL486112 1 9.25
CHEMBL524732 1 9.24
CHEMBL507279 1 9.13
CHEMBL503584 1 9.11
CHEMBL488778 1 9.09
CHEMBL505720 1 9.02
CHEMBL451066 1 8.93
CHEMBL504391 1 8.92
CHEMBL484616 1 8.87
CHEMBL524548 1 8.83
CHEMBL526504 1 8.82
CHEMBL484615 1 8.78
CHEMBL497067 1 8.75
CHEMBL507020 1 8.75
CHEMBL507281 1 8.66
CHEMBL524370 1 8.64
CHEMBL487955 1 8.62

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL224485 IC50 = 0.17 nM 9.77
CHEMBL505189 IC50 = 0.24 nM 9.62
CHEMBL505455 IC50 = 0.37 nM 9.43
CHEMBL505190 IC50 = 0.38 nM 9.42
CHEMBL519886 IC50 = 0.39 nM 9.41
CHEMBL501749 IC50 = 0.4 nM 9.40
CHEMBL527118 IC50 = 0.41 nM 9.39
CHEMBL525274 IC50 = 0.42 nM 9.38
CHEMBL506772 IC50 = 0.43 nM 9.37
CHEMBL485704 IC50 = 0.47 nM 9.33
CHEMBL506771 IC50 = 0.47 nM 9.33
CHEMBL502293 IC50 = 0.51 nM 9.29
CHEMBL520364 IC50 = 0.53 nM 9.28
CHEMBL486112 IC50 = 0.56 nM 9.25
CHEMBL524732 IC50 = 0.57 nM 9.24
CHEMBL507279 IC50 = 0.74 nM 9.13
CHEMBL503584 IC50 = 0.77 nM 9.11
CHEMBL488778 IC50 = 0.82 nM 9.09
CHEMBL505720 IC50 = 0.95 nM 9.02
CHEMBL451066 IC50 = 1.18 nM 8.93
CHEMBL504391 IC50 = 1.21 nM 8.92
CHEMBL484616 IC50 = 1.34 nM 8.87
CHEMBL524548 IC50 = 1.47 nM 8.83
CHEMBL526504 IC50 = 1.51 nM 8.82
CHEMBL484615 IC50 = 1.66 nM 8.78
CHEMBL497067 IC50 = 1.77 nM 8.75
CHEMBL507020 IC50 = 1.77 nM 8.75
CHEMBL507281 IC50 = 2.19 nM 8.66
CHEMBL524370 IC50 = 2.29 nM 8.64
CHEMBL487955 IC50 = 2.42 nM 8.62
CHEMBL487956 IC50 = 2.87 nM 8.54
CHEMBL504657 IC50 = 3.02 nM 8.52
CHEMBL499632 IC50 = 3.04 nM 8.52
CHEMBL523251 IC50 = 3.54 nM 8.45
CHEMBL502292 IC50 = 4.39 nM 8.36
CHEMBL485705 IC50 = 5.99 nM 8.22
CHEMBL498545 IC50 = 22.14 nM 7.66
CHEMBL500948 IC50 = 41.38 nM 7.38
CHEMBL526193 IC50 - -
CHEMBL502557 IC50 - -
CHEMBL500947 IC50 - -
CHEMBL498047 IC50 - -
CHEMBL498726 IC50 - -
CHEMBL499829 IC50 - -
CHEMBL501218 IC50 - -