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Assay Detail

CHEMBL2045976

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

Binding
Inhibition of HIV1 reverse transcriptase using poly(ra)/oligo(dT)15 homopolymer template as substrate after 1 hr
25
Total Activities
25
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 Autocuration

Target

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

Publication

Design, synthesis, and biological evaluation of 1-[(2-benzyloxyl/alkoxyl)methyl]-5-halo-6-aryluracils as potent HIV-1 non-nucleoside reverse transcriptase inhibitors with an improved drug resistance profile.
Wang X, Zhang J, Huang Y, Wang R, Zhang L, Qiao K, Li L, Liu C, Ouyang Y, Xu W, Zhang Z, Zhang L, Shao Y, Jiang S, Ma L, Liu J.
J Med Chem (2012) 55 : 2242 -2250
PubMed 22283377 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 25 6.76 8.52

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL2041783 1 8.52
CHEMBL2041782 1 8.00
CHEMBL2041791 1 7.92
CHEMBL2041784 1 7.82
CHEMBL436546 1 7.70
CHEMBL2041792 1 7.68
CHEMBL2041790 1 7.41
CHEMBL2041788 1 7.37
CHEMBL2041780 1 6.96
CHEMBL2041779 1 6.94
CHEMBL35033 EMIVIRINE 2.0 1 6.82
CHEMBL2041789 1 6.79
CHEMBL2041786 1 6.68
CHEMBL2041787 1 5.82
CHEMBL2041785 1 5.74
CHEMBL57 NEVIRAPINE 4.0 1 5.38
CHEMBL2041965 1 5.14
CHEMBL2041781 1 4.93
CHEMBL2041969 1 4.79
CHEMBL2041794 1 -
CHEMBL2041964 1 -
CHEMBL2041966 1 -
CHEMBL2041967 1 -
CHEMBL2041968 1 -
CHEMBL2041793 1 -

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL2041783 IC50 = 3.0 nM 8.52
CHEMBL2041782 IC50 = 10.0 nM 8.00
CHEMBL2041791 IC50 = 12.0 nM 7.92
CHEMBL2041784 IC50 = 15.0 nM 7.82
CHEMBL436546 IC50 = 20.0 nM 7.70
CHEMBL2041792 IC50 = 21.0 nM 7.68
CHEMBL2041790 IC50 = 39.0 nM 7.41
CHEMBL2041788 IC50 = 43.0 nM 7.37
CHEMBL2041780 IC50 = 110.0 nM 6.96
CHEMBL2041779 IC50 = 114.0 nM 6.94
CHEMBL35033 EMIVIRINE IC50 = 150.0 nM 6.82
CHEMBL2041789 IC50 = 162.0 nM 6.79
CHEMBL2041786 IC50 = 210.0 nM 6.68
CHEMBL2041787 IC50 = 1521.0 nM 5.82
CHEMBL2041785 IC50 = 1825.0 nM 5.74
CHEMBL57 NEVIRAPINE IC50 = 4120.0 nM 5.38
CHEMBL2041965 IC50 = 7217.0 nM 5.14
CHEMBL2041781 IC50 = 11850.0 nM 4.93
CHEMBL2041969 IC50 = 16338.0 nM 4.79
CHEMBL2041794 IC50 > 100000.0 nM -
CHEMBL2041964 IC50 > 100000.0 nM -
CHEMBL2041966 IC50 > 100000.0 nM -
CHEMBL2041967 IC50 > 100000.0 nM -
CHEMBL2041968 IC50 > 100000.0 nM -
CHEMBL2041793 IC50 > 100000.0 nM -