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Assay Detail

CHEMBL699303

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Binding
Inhibitory activity against HIV-1 integrase
39
Total Activities
38
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

HIV-1 integrase pharmacophore model derived from diverse classes of inhibitors.
Mustata GI, Brigo A, Briggs JM.
Bioorg Med Chem Lett (2004) 14 : 1447 -1454
PubMed 15006380 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 39 6.22 8.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL32865 1 8.00
CHEMBL36070 1 7.40
CHEMBL320261 1 7.23
CHEMBL409132 1 7.16
CHEMBL216058 1 7.05
CHEMBL403498 1 7.00
CHEMBL421353 1 6.90
CHEMBL1159990 2 6.64
CHEMBL1159993 1 6.58
CHEMBL1159989 1 6.50
CHEMBL32711 1 6.48
CHEMBL1159988 1 6.44
CHEMBL35842 1 6.43
CHEMBL472863 1 6.43
CHEMBL433434 1 6.22
CHEMBL288097 1 6.22
CHEMBL366356 DIGALLIC ACID 1 6.22
CHEMBL36303 1 6.16
CHEMBL3138501 1 6.01
CHEMBL1159991 1 5.82
CHEMBL285415 1 5.68
CHEMBL284384 1 5.43
CHEMBL369379 1 5.21
CHEMBL285489 1 5.13
CHEMBL36463 1 4.70
CHEMBL285696 1 4.47
CHEMBL33475 1 4.33
CHEMBL32853 1 -
CHEMBL368615 1 -
CHEMBL287689 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL32865 IC50 = 10.0 nM 8.00
CHEMBL36070 IC50 = 40.0 nM 7.40
CHEMBL320261 IC50 = 59.0 nM 7.23
CHEMBL409132 IC50 = 70.0 nM 7.16
CHEMBL216058 IC50 = 90.0 nM 7.05
CHEMBL403498 IC50 = 100.0 nM 7.00
CHEMBL421353 IC50 = 126.0 nM 6.90
CHEMBL1159990 IC50 = 230.0 nM 6.64
CHEMBL1159993 IC50 = 260.0 nM 6.58
CHEMBL1159989 IC50 = 320.0 nM 6.50
CHEMBL32711 IC50 = 330.0 nM 6.48
CHEMBL1159988 IC50 = 360.0 nM 6.44
CHEMBL35842 IC50 = 370.0 nM 6.43
CHEMBL472863 IC50 = 370.0 nM 6.43
CHEMBL1159990 IC50 = 440.0 nM 6.36
CHEMBL366356 DIGALLIC ACID IC50 = 600.0 nM 6.22
CHEMBL433434 IC50 = 600.0 nM 6.22
CHEMBL288097 IC50 = 600.0 nM 6.22
CHEMBL36303 IC50 = 700.0 nM 6.16
CHEMBL3138501 IC50 = 970.0 nM 6.01
CHEMBL1159991 IC50 = 1500.0 nM 5.82
CHEMBL285415 IC50 = 2100.0 nM 5.68
CHEMBL284384 IC50 = 3700.0 nM 5.43
CHEMBL369379 IC50 = 6100.0 nM 5.21
CHEMBL285489 IC50 = 7400.0 nM 5.13
CHEMBL36463 IC50 = 20000.0 nM 4.70
CHEMBL285696 IC50 = 33600.0 nM 4.47
CHEMBL33475 IC50 = 47000.0 nM 4.33
CHEMBL33193 IC50 > 200000.0 nM -
CHEMBL441600 IC50 > 293000.0 nM -
CHEMBL32747 IC50 = 123000.0 nM -
CHEMBL32810 IC50 = 325000.0 nM -
CHEMBL284144 IC50 = 331000.0 nM -
CHEMBL32853 IC50 = 322000.0 nM -
CHEMBL35109 IC50 > 200000.0 nM -
CHEMBL32804 IC50 = 1000000.0 nM -
CHEMBL287689 IC50 > 100000.0 nM -
CHEMBL367553 IC50 = 182200.0 nM -
CHEMBL368615 IC50 = 224000.0 nM -