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Assay Detail

CHEMBL871193

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Binding
Inhibition of HIV1 recombinant integrase
20
Total Activities
20
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Organism Human immunodeficiency virus 1
Confidence 9 — Direct single protein target
Curated By Expert

Target

Human immunodeficiency virus type 1 integrase (CHEMBL3471)
Type SINGLE PROTEIN
Organism Human immunodeficiency virus 1

Publication

Triketoacid inhibitors of HIV-integrase: a new chemotype useful for probing the integrase pharmacophore.
Walker MA, Johnson T, Ma Z, Banville J, Remillard R, Kim O, Zhang Y, Staab A, Wong H, Torri A, Samanta H, Lin Z, Deminie C, Terry B, Krystal M, Meanwell N.
Bioorg Med Chem Lett (2006) 16 : 2920 -2924
PubMed 16546383 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 20 5.29 6.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL50605 1 6.52
CHEMBL108760 1 6.40
CHEMBL209614 1 6.22
CHEMBL211014 1 6.00
CHEMBL210374 1 5.70
CHEMBL209827 1 5.52
CHEMBL208806 1 5.40
CHEMBL210977 1 5.30
CHEMBL210373 1 5.22
CHEMBL209879 1 5.22
CHEMBL377263 1 5.16
CHEMBL210870 1 5.10
CHEMBL209205 1 5.05
CHEMBL209713 1 4.58
CHEMBL210996 1 4.52
CHEMBL448424 1 4.10
CHEMBL210962 1 4.00
CHEMBL210863 1 -
CHEMBL379425 1 -
CHEMBL210094 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL50605 IC50 = 300.0 nM 6.52
CHEMBL108760 IC50 = 400.0 nM 6.40
CHEMBL209614 IC50 = 600.0 nM 6.22
CHEMBL211014 IC50 = 1000.0 nM 6.00
CHEMBL210374 IC50 = 2000.0 nM 5.70
CHEMBL209827 IC50 = 3000.0 nM 5.52
CHEMBL208806 IC50 = 4000.0 nM 5.40
CHEMBL210977 IC50 = 5000.0 nM 5.30
CHEMBL210373 IC50 = 6000.0 nM 5.22
CHEMBL209879 IC50 = 6000.0 nM 5.22
CHEMBL377263 IC50 = 7000.0 nM 5.16
CHEMBL210870 IC50 = 8000.0 nM 5.10
CHEMBL209205 IC50 = 9000.0 nM 5.05
CHEMBL209713 IC50 = 26000.0 nM 4.58
CHEMBL210996 IC50 = 30000.0 nM 4.52
CHEMBL448424 IC50 = 80000.0 nM 4.10
CHEMBL210962 IC50 = 100000.0 nM 4.00
CHEMBL210863 IC50 > 300000.0 nM -
CHEMBL379425 IC50 = 125000.0 nM -
CHEMBL210094 IC50 > 125000.0 nM -