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Assay Detail

CHEMBL3755387

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Binding
Inhibition of HIV1 reverse transcriptase
ChEMBL ↗
48
Total Activities
45
Compounds Tested
2
Activity Types
0
Assay Parameters

Assay Information

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

Target

Human immunodeficiency virus type 1 reverse transcriptase (CHEMBL247) ↗
Type SINGLE PROTEIN
Organism Human immunodeficiency virus 1

Publication

Efavirenz a nonnucleoside reverse transcriptase inhibitor of first-generation: Approaches based on its medicinal chemistry.
Bastos MM, Costa CC, Bezerra TC, da Silva Fde C, Boechat N.
Eur J Med Chem (2016) 108 : 455 -465
PubMed 26708112 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC90 26 - -
IC50 22 7.05 9.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL3753575 — — 1 9.00
CHEMBL3754535 — — 1 9.00
CHEMBL378856 — — 1 8.70
CHEMBL3753096 — — 1 8.22
CHEMBL309896 — — 1 7.92
CHEMBL29274 — — 1 7.64
CHEMBL443942 — — 1 7.60
CHEMBL283619 — — 2 7.50
CHEMBL223228 EFAVIRENZ 4.0 2 7.42
CHEMBL301370 OPAVIRALINE 2.0 2 7.35
CHEMBL3754322 — — 1 7.34
CHEMBL473119 — — 1 7.30
CHEMBL3753238 — — 1 7.25
CHEMBL3753009 — — 1 7.23
CHEMBL2114369 — — 1 7.09
CHEMBL3753006 — — 1 6.10
CHEMBL3754170 — — 1 6.02
CHEMBL2262683 — — 1 5.47
CHEMBL2262682 — — 1 5.44
CHEMBL84383 — — 1 5.22
CHEMBL2262681 — — 1 5.15
CHEMBL2262684 — — 1 5.08
CHEMBL102668 — — 1 -
CHEMBL3753822 — — 1 -
CHEMBL3754169 — — 1 -
CHEMBL3752849 — — 1 -
CHEMBL3752646 — — 1 -
CHEMBL101745 — — 1 -
CHEMBL273285 — — 1 -
CHEMBL101024 — — 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL3753575 — IC50 = 1.0 nM 9.00
CHEMBL3754535 — IC50 = 1.0 nM 9.00
CHEMBL378856 — IC50 = 2.0 nM 8.70
CHEMBL3753096 — IC50 = 6.0 nM 8.22
CHEMBL309896 — IC50 = 12.0 nM 7.92
CHEMBL29274 — IC50 = 23.0 nM 7.64
CHEMBL443942 — IC50 = 25.0 nM 7.60
CHEMBL283619 — IC50 = 32.0 nM 7.50
CHEMBL223228 EFAVIRENZ IC50 = 38.0 nM 7.42
CHEMBL301370 OPAVIRALINE IC50 = 45.0 nM 7.35
CHEMBL3754322 — IC50 = 46.0 nM 7.34
CHEMBL473119 — IC50 = 50.0 nM 7.30
CHEMBL3753238 — IC50 = 56.0 nM 7.25
CHEMBL3753009 — IC50 = 59.0 nM 7.23
CHEMBL2114369 — IC50 = 82.0 nM 7.09
CHEMBL3753006 — IC50 = 800.0 nM 6.10
CHEMBL3754170 — IC50 = 950.0 nM 6.02
CHEMBL2262683 — IC50 = 3410.0 nM 5.47
CHEMBL2262682 — IC50 = 3610.0 nM 5.44
CHEMBL84383 — IC50 = 6070.0 nM 5.22
CHEMBL2262681 — IC50 = 7100.0 nM 5.15
CHEMBL2262684 — IC50 = 8370.0 nM 5.08
CHEMBL100518 — IC90 = 9.02 nM -
CHEMBL101881 — IC90 = 8.33 nM -
CHEMBL3752646 — IC90 = 295.6 nM -
CHEMBL3752849 — IC90 = 6.0 nM -
CHEMBL3752354 — IC90 = 3.8 nM -
CHEMBL3752360 — IC90 = 5.39 nM -
CHEMBL3752925 — IC90 = 10.07 nM -
CHEMBL3754746 — IC90 = 10.19 nM -
CHEMBL3753590 — IC90 = 18.26 nM -
CHEMBL3754561 — IC90 = 2.68 nM -
CHEMBL3753961 — IC90 = 3.9 nM -
CHEMBL283619 — IC90 = 2.7 nM -
CHEMBL416853 — IC90 = 3.0 nM -
CHEMBL103395 — IC90 = 20.59 nM -
CHEMBL318833 — IC90 = 4.35 nM -
CHEMBL330659 — IC90 = 18.89 nM -
CHEMBL318000 — IC90 = 7.35 nM -
CHEMBL101024 — IC90 = 10.31 nM -
CHEMBL273285 — IC90 = 7.11 nM -
CHEMBL101745 — IC90 = 0.83 nM -
CHEMBL3754079 — IC90 = 279.09 nM -
CHEMBL3753822 — IC90 = 40.0 nM -
CHEMBL3754169 — IC90 = 32.0 nM -
CHEMBL223228 EFAVIRENZ IC90 = 1.7 nM -
CHEMBL301370 OPAVIRALINE IC90 = 4.8 nM -
CHEMBL102668 — IC90 = 2.0 nM -