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Assay Detail

CHEMBL802044

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

Binding
Inhibition of HIV-1 reverse transcriptase (HIV-1 RT)
18
Total Activities
18
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 reverse transcriptase (CHEMBL247)
Type SINGLE PROTEIN
Organism Human immunodeficiency virus 1

Publication

Principal components describing biological activities and molecular diversity of heterocyclic aromatic ring fragments.
Gibson S, McGuire R, Rees DC.
J Med Chem (1996) 39 : 4065 -4072
PubMed 8831772 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 18 5.35 6.68

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL415320 1 6.68
CHEMBL316785 1 6.48
CHEMBL125510 1 6.47
CHEMBL431274 1 6.46
CHEMBL318730 1 6.34
CHEMBL121835 1 6.30
CHEMBL123639 1 6.28
CHEMBL125873 1 5.68
CHEMBL125867 1 5.36
CHEMBL86064 1 5.27
CHEMBL98394 1 5.12
CHEMBL339138 1 4.82
CHEMBL340255 1 4.65
CHEMBL338129 1 4.54
CHEMBL123735 1 4.49
CHEMBL123968 1 3.98
CHEMBL125702 1 3.84
CHEMBL85975 1 3.52

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL415320 IC50 = 208.93 nM 6.68
CHEMBL316785 IC50 = 331.13 nM 6.48
CHEMBL125510 IC50 = 338.84 nM 6.47
CHEMBL431274 IC50 = 346.74 nM 6.46
CHEMBL318730 IC50 = 457.09 nM 6.34
CHEMBL121835 IC50 = 501.19 nM 6.30
CHEMBL123639 IC50 = 524.81 nM 6.28
CHEMBL125873 IC50 = 2089.3 nM 5.68
CHEMBL125867 IC50 = 4365.16 nM 5.36
CHEMBL86064 IC50 = 5370.32 nM 5.27
CHEMBL98394 IC50 = 7585.78 nM 5.12
CHEMBL339138 IC50 = 15135.61 nM 4.82
CHEMBL340255 IC50 = 22387.21 nM 4.65
CHEMBL338129 IC50 = 28840.32 nM 4.54
CHEMBL123735 IC50 = 32359.37 nM 4.49
CHEMBL123968 IC50 = 104712.85 nM 3.98
CHEMBL125702 IC50 = 144543.98 nM 3.84
CHEMBL85975 IC50 = 301995.17 nM 3.52