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Assay Detail

CHEMBL800581

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Binding
Inhibitory activity against HIV-1 reverse transcriptase
16
Total Activities
15
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Binding
Confidence 8 — Homologous single protein target
Curated By Expert

Target

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

Publication

All-atom models for the non-nucleoside binding site of HIV-1 reverse transcriptase complexed with inhibitors: a 3D QSAR approach.
Gussio R, Pattabiraman N, Zaharevitz DW, Kellogg GE, Topol IA, Rice WG, Schaeffer CA, Erickson JW, Burt SK.
J Med Chem (1996) 39 : 1645 -1650
PubMed 8648604 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 16 5.47 6.72

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL42906 1 6.72
CHEMBL295978 1 6.22
CHEMBL42132 1 5.91
CHEMBL297982 1 5.79
CHEMBL43308 1 5.69
CHEMBL288062 1 5.62
CHEMBL43283 1 5.57
CHEMBL431931 1 5.41
CHEMBL43324 1 5.41
CHEMBL44392 1 5.25
CHEMBL57 NEVIRAPINE 4.0 1 5.19
CHEMBL37628 1 4.99
CHEMBL297115 2 4.95
CHEMBL290204 1 4.94
CHEMBL295930 1 4.91

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL42906 IC50 = 190.0 nM 6.72
CHEMBL295978 IC50 = 600.0 nM 6.22
CHEMBL42132 IC50 = 1220.0 nM 5.91
CHEMBL297982 IC50 = 1620.0 nM 5.79
CHEMBL43308 IC50 = 2050.0 nM 5.69
CHEMBL288062 IC50 = 2400.0 nM 5.62
CHEMBL43283 IC50 = 2700.0 nM 5.57
CHEMBL431931 IC50 = 3900.0 nM 5.41
CHEMBL43324 IC50 = 3900.0 nM 5.41
CHEMBL44392 IC50 = 5630.0 nM 5.25
CHEMBL57 NEVIRAPINE IC50 = 6440.0 nM 5.19
CHEMBL37628 IC50 = 10300.0 nM 4.99
CHEMBL297115 IC50 = 11200.0 nM 4.95
CHEMBL297115 IC50 = 11200.0 nM 4.95
CHEMBL290204 IC50 = 11500.0 nM 4.94
CHEMBL295930 IC50 = 12200.0 nM 4.91