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Assay Detail

CHEMBL5049323

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

Functional
Antiviral activity against recombinant HIV1 NLRep-Rluc harbouring polymorphic T124/T125 integrase infected in human MT-2 cells assessed as inhibition of virus growth in presence of fetal bovine serum by measuring luciferase activity after 5 days
35
Total Activities
33
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Human immunodeficiency virus 1
Cell Type MT2
Confidence 1 — Organism
Curated By Autocuration

Target

Human immunodeficiency virus 1 (CHEMBL378)
Type ORGANISM
Organism Human immunodeficiency virus 1

Publication

Design, Synthesis, and Preclinical Profiling of GSK3739936 (BMS-986180), an Allosteric Inhibitor of HIV-1 Integrase with Broad-Spectrum Activity toward 124/125 Polymorphs.
Naidu BN, Patel M, McAuliffe B, Ding B, Cianci C, Simmermacher J, Jenkins S, Parker DD, Sivaprakasam P, Khan JA, Kish K, Lewis H, Hanumegowda U, Krystal M, Meanwell NA, Kadow JF.
J Med Chem (2022) 65 : 4949 -4971
PubMed 35235334 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
EC50 35 8.29 9.22

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL5089130 2 9.22
CHEMBL5080445 1 9.22
CHEMBL5074148 1 9.10
CHEMBL5087287 1 9.05
CHEMBL5089101 1 8.96
CHEMBL5094894 1 8.89
CHEMBL5078859 1 8.82
CHEMBL5077187 1 8.82
CHEMBL5084420 1 8.77
CHEMBL5093378 1 8.77
CHEMBL5091879 1 8.64
CHEMBL5084138 1 8.57
CHEMBL5093292 1 8.55
CHEMBL5088057 1 8.48
CHEMBL5077625 1 8.44
CHEMBL5076276 1 8.41
CHEMBL5087982 1 8.36
CHEMBL5087777 1 8.32
CHEMBL5079235 2 8.30
CHEMBL5087827 1 8.30
CHEMBL5077943 1 8.27
CHEMBL5092389 1 7.95
CHEMBL5085847 1 7.92
CHEMBL5080580 1 7.92
CHEMBL5070004 1 7.91
CHEMBL5077638 1 7.83
CHEMBL5080087 1 7.81
CHEMBL5092167 1 7.65
CHEMBL5090529 1 7.51
CHEMBL5080240 1 7.43

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL5080445 EC50 = 0.6 nM 9.22
CHEMBL5089130 EC50 = 0.6 nM 9.22
CHEMBL5074148 EC50 = 0.8 nM 9.10
CHEMBL5087287 EC50 = 0.9 nM 9.05
CHEMBL5089101 EC50 = 1.1 nM 8.96
CHEMBL5094894 EC50 = 1.3 nM 8.89
CHEMBL5078859 EC50 = 1.5 nM 8.82
CHEMBL5077187 EC50 = 1.5 nM 8.82
CHEMBL5084420 EC50 = 1.7 nM 8.77
CHEMBL5093378 EC50 = 1.7 nM 8.77
CHEMBL5089130 EC50 = 2.0 nM 8.70
CHEMBL5091879 EC50 = 2.3 nM 8.64
CHEMBL5084138 EC50 = 2.7 nM 8.57
CHEMBL5093292 EC50 = 2.8 nM 8.55
CHEMBL5088057 EC50 = 3.3 nM 8.48
CHEMBL5077625 EC50 = 3.6 nM 8.44
CHEMBL5076276 EC50 = 3.9 nM 8.41
CHEMBL5087982 EC50 = 4.4 nM 8.36
CHEMBL5087777 EC50 = 4.8 nM 8.32
CHEMBL5087827 EC50 = 5.0 nM 8.30
CHEMBL5079235 EC50 = 5.0 nM 8.30
CHEMBL5077943 EC50 = 5.4 nM 8.27
CHEMBL5092389 EC50 = 11.3 nM 7.95
CHEMBL5085847 EC50 = 11.9 nM 7.92
CHEMBL5079235 EC50 = 12.0 nM 7.92
CHEMBL5080580 EC50 = 12.0 nM 7.92
CHEMBL5070004 EC50 = 12.2 nM 7.91
CHEMBL5077638 EC50 = 14.7 nM 7.83
CHEMBL5080087 EC50 = 15.6 nM 7.81
CHEMBL5092167 EC50 = 22.6 nM 7.65
CHEMBL5090529 EC50 = 31.2 nM 7.51
CHEMBL5080240 EC50 = 37.5 nM 7.43
CHEMBL3259907 BI-224436 EC50 = 49.0 nM 7.31
CHEMBL5080247 EC50 = 67.0 nM 7.17
CHEMBL5081928 EC50 = 190.0 nM 6.72