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Assay Detail

CHEMBL3744883

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

Binding
Inhibition of Dengue virus serotype-2 NS2B-NS3 protease using 2-Abz-Nle-Lys-Arg-Arg-Ser-(3-NO2)-Tyr-NH2 as substrate preincubated with protein for 15 mins followed by substrate addition measured for 15 mins by FRET assay
88
Total Activities
85
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism dengue virus type 2
Confidence 0 — Uncurated / Unknown
Curated By Autocuration

Target

Unchecked (CHEMBL612545)
Type UNCHECKED

Publication

Discovery of Nanomolar Dengue and West Nile Virus Protease Inhibitors Containing a 4-Benzyloxyphenylglycine Residue.
Behnam MA, Graf D, Bartenschlager R, Zlotos DP, Klein CD.
J Med Chem (2015) 58 : 9354 -9370
PubMed 26562070 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 85 6.60 7.75
Ki 3 7.38 7.92

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3740727 2 7.92
CHEMBL3739493 2 7.72
CHEMBL3741832 1 7.33
CHEMBL3740386 1 7.30
CHEMBL3740686 1 7.21
CHEMBL3740745 1 7.17
CHEMBL3740133 1 7.16
CHEMBL3739872 1 7.15
CHEMBL3740757 1 7.10
CHEMBL3739737 1 7.00
CHEMBL3740340 1 6.96
CHEMBL3740603 1 6.96
CHEMBL3739995 1 6.92
CHEMBL3739622 1 6.92
CHEMBL3740519 1 6.89
CHEMBL3739978 1 6.89
CHEMBL3741227 1 6.84
CHEMBL3741143 1 6.83
CHEMBL3739908 1 6.83
CHEMBL3740226 1 6.82
CHEMBL3741034 1 6.80
CHEMBL3739888 1 6.80
CHEMBL3741620 1 6.79
CHEMBL3741198 1 6.77
CHEMBL3740285 1 6.76
CHEMBL3739794 1 6.76
CHEMBL3741958 1 6.75
CHEMBL3741713 1 6.75
CHEMBL3739705 1 6.75
CHEMBL3740968 1 6.75

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3740727 Ki = 12.0 nM 7.92
CHEMBL3740727 IC50 = 18.0 nM 7.75
CHEMBL3739493 Ki = 19.0 nM 7.72
CHEMBL3739493 IC50 = 28.0 nM 7.55
CHEMBL3741832 IC50 = 47.0 nM 7.33
CHEMBL3740386 IC50 = 50.0 nM 7.30
CHEMBL3740686 IC50 = 61.0 nM 7.21
CHEMBL3740745 IC50 = 68.0 nM 7.17
CHEMBL3740133 IC50 = 69.0 nM 7.16
CHEMBL3739872 IC50 = 71.0 nM 7.15
CHEMBL3740757 IC50 = 79.0 nM 7.10
CHEMBL3739737 IC50 = 99.0 nM 7.00
CHEMBL3740340 IC50 = 109.0 nM 6.96
CHEMBL3740603 IC50 = 111.0 nM 6.96
CHEMBL3739995 IC50 = 120.0 nM 6.92
CHEMBL3739622 IC50 = 121.0 nM 6.92
CHEMBL3739978 IC50 = 129.0 nM 6.89
CHEMBL3740519 IC50 = 130.0 nM 6.89
CHEMBL3741227 IC50 = 143.0 nM 6.84
CHEMBL3741143 IC50 = 148.0 nM 6.83
CHEMBL3739908 IC50 = 147.0 nM 6.83
CHEMBL3740226 IC50 = 151.0 nM 6.82
CHEMBL3739888 IC50 = 157.0 nM 6.80
CHEMBL3741034 IC50 = 158.0 nM 6.80
CHEMBL3741620 IC50 = 164.0 nM 6.79
CHEMBL3741198 IC50 = 170.0 nM 6.77
CHEMBL3739794 IC50 = 173.0 nM 6.76
CHEMBL3740285 IC50 = 173.0 nM 6.76
CHEMBL3739705 IC50 = 179.0 nM 6.75
CHEMBL3740968 IC50 = 177.0 nM 6.75
CHEMBL3741713 IC50 = 176.0 nM 6.75
CHEMBL3741958 IC50 = 177.0 nM 6.75
CHEMBL3740444 IC50 = 181.0 nM 6.74
CHEMBL3741849 IC50 = 183.0 nM 6.74
CHEMBL3739438 IC50 = 182.0 nM 6.74
CHEMBL3742054 IC50 = 186.0 nM 6.73
CHEMBL3742057 IC50 = 192.0 nM 6.72
CHEMBL3741725 IC50 = 194.0 nM 6.71
CHEMBL3740845 IC50 = 197.0 nM 6.71
CHEMBL3740985 IC50 = 194.0 nM 6.71
CHEMBL3741557 IC50 = 196.0 nM 6.71
CHEMBL3740868 IC50 = 199.0 nM 6.70
CHEMBL3740600 IC50 = 203.0 nM 6.69
CHEMBL3739504 IC50 = 215.0 nM 6.67
CHEMBL3741786 IC50 = 236.0 nM 6.63
CHEMBL3741633 IC50 = 232.0 nM 6.63
CHEMBL3742397 IC50 = 243.0 nM 6.61
CHEMBL3741714 IC50 = 262.0 nM 6.58
CHEMBL3741232 IC50 = 301.0 nM 6.52
CHEMBL3740465 IC50 = 304.0 nM 6.52