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Assay Detail

CHEMBL5604070

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Functional
Functional biochemical assay to identify treatments for viral infectious disease that targets Dengue virus type 2 NS2B-NS3 protease. Utilizing a direct enzyme activity measurement method, reading the fluorescence intensity is used to characterize the relative potency of inhibitors as IC50. Synthetic construct has been made based on Dengue virus type 2 (strain Thailand/16681/1984) by Centre for Medicines Discovery, University of Oxford, and the assay has been performed by Enamine biological services, Bienta Ltd.The protocol is publicly available: dx.doi.org/10.17504/protocols.io.kqdg32m87v25/v1
ChEMBL ↗
2117
Total Activities
1805
Compounds Tested
1
Activity Types
1
Assay Parameters

Assay Information

Assay Type Functional
Organism dengue virus type 2
Confidence 9 — Direct single protein target
Curated By Autocuration

Target

Genome polyprotein (CHEMBL5980) ↗
Type SINGLE PROTEIN
Organism dengue virus type 2

Publication

ASAP - DENV-2 NS2B-NS3 protease fluorescence dose response
ASAP Discovery Consortium
(2024)
· DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 2117 4.86 6.65

Assay Parameters

Parameter Type Value Units Text
Construct protein sequence Construct protein sequence - — SMADLELERAADVKWEDQAEISGSSPILSITISEDGSMSIKNEEEEQTLGGGGSGGGGAGVLWDVPSPPPMGKAELEDGAYRIKQKGILGYSQIGAGVYKEGTFHTMWHVTRGAVLMHKGKRIEPSWADVKKDLISYGGGWKLEGEWKEGEEVQVLALEPGKNPRAVQTKPGLFKTNAGTIGAVSLDFSPGTSGSPIIDKKGKVVGLYGNGVVTRSGAYVSAIAQTEKSIEDNPEIEDDIFRK

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3919119 — — 39 6.65
CHEMBL3740727 — — 39 5.93
CHEMBL569561 — — 9 5.66
CHEMBL5604424 — — 7 5.44
CHEMBL5605982 — — 2 5.41
CHEMBL5605142 — — 6 5.38
CHEMBL5605654 — — 2 5.38
CHEMBL5605005 — — 2 5.38
CHEMBL5605065 — — 2 5.32
CHEMBL5604806 — — 2 5.31
CHEMBL5605928 — — 2 5.30
CHEMBL5604846 — — 2 5.30
CHEMBL5605716 — — 2 5.30
CHEMBL5605639 — — 2 5.29
CHEMBL5598626 — — 1 5.29
CHEMBL5604991 — — 2 5.29
CHEMBL5604955 — — 9 5.28
CHEMBL5599838 — — 5 5.28
CHEMBL5605207 — — 2 5.27
CHEMBL5598703 — — 2 5.27
CHEMBL5598902 — — 1 5.27
CHEMBL5604726 — — 2 5.27
CHEMBL5606303 — — 2 5.25
CHEMBL5598922 — — 2 5.25
CHEMBL5606160 — — 1 5.24
CHEMBL5598717 — — 2 5.23
CHEMBL5598684 — — 2 5.22
CHEMBL5598876 — — 2 5.19
CHEMBL5604328 — — 4 5.18
CHEMBL5605281 — — 2 5.17

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3919119 — IC50 = 222.0 nM 6.65
CHEMBL3919119 — IC50 = 243.0 nM 6.61
CHEMBL3919119 — IC50 = 257.0 nM 6.59
CHEMBL3919119 — IC50 = 267.0 nM 6.57
CHEMBL3919119 — IC50 = 273.0 nM 6.56
CHEMBL3919119 — IC50 = 288.0 nM 6.54
CHEMBL3919119 — IC50 = 298.0 nM 6.53
CHEMBL3919119 — IC50 = 305.0 nM 6.52
CHEMBL3919119 — IC50 = 302.0 nM 6.52
CHEMBL3919119 — IC50 = 304.0 nM 6.52
CHEMBL3919119 — IC50 = 309.0 nM 6.51
CHEMBL3919119 — IC50 = 311.0 nM 6.51
CHEMBL3919119 — IC50 = 321.0 nM 6.49
CHEMBL3919119 — IC50 = 328.0 nM 6.48
CHEMBL3919119 — IC50 = 347.0 nM 6.46
CHEMBL3919119 — IC50 = 358.0 nM 6.45
CHEMBL3919119 — IC50 = 356.0 nM 6.45
CHEMBL3919119 — IC50 = 358.0 nM 6.45
CHEMBL3919119 — IC50 = 367.0 nM 6.43
CHEMBL3919119 — IC50 = 370.0 nM 6.43
CHEMBL3919119 — IC50 = 384.0 nM 6.42
CHEMBL3919119 — IC50 = 379.0 nM 6.42
CHEMBL3919119 — IC50 = 378.0 nM 6.42
CHEMBL3919119 — IC50 = 387.0 nM 6.41
CHEMBL3919119 — IC50 = 386.0 nM 6.41
CHEMBL3919119 — IC50 = 398.0 nM 6.40
CHEMBL3919119 — IC50 = 401.0 nM 6.40
CHEMBL3919119 — IC50 = 401.0 nM 6.40
CHEMBL3919119 — IC50 = 397.0 nM 6.40
CHEMBL3919119 — IC50 = 409.0 nM 6.39
CHEMBL3919119 — IC50 = 421.0 nM 6.38
CHEMBL3919119 — IC50 = 437.0 nM 6.36
CHEMBL3919119 — IC50 = 445.0 nM 6.35
CHEMBL3919119 — IC50 = 458.0 nM 6.34
CHEMBL3919119 — IC50 = 503.0 nM 6.30
CHEMBL3919119 — IC50 = 512.0 nM 6.29
CHEMBL3919119 — IC50 = 516.0 nM 6.29
CHEMBL3919119 — IC50 = 540.0 nM 6.27
CHEMBL3740727 — IC50 = 1166.0 nM 5.93
CHEMBL3740727 — IC50 = 1460.0 nM 5.84
CHEMBL3740727 — IC50 = 1715.0 nM 5.77
CHEMBL3740727 — IC50 = 1711.0 nM 5.77
CHEMBL3740727 — IC50 = 1865.0 nM 5.73
CHEMBL3740727 — IC50 = 1911.0 nM 5.72
CHEMBL3740727 — IC50 = 2096.0 nM 5.68
CHEMBL3740727 — IC50 = 2121.0 nM 5.67
CHEMBL569561 — IC50 = 2172.0 nM 5.66
CHEMBL3740727 — IC50 = 2168.0 nM 5.66
CHEMBL3740727 — IC50 = 2198.0 nM 5.66
CHEMBL569561 — IC50 = 2234.0 nM 5.65