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Assay Detail

CHEMBL802994

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

Binding
Inhibition of HIV-1 Mutant HIV-1 RT enzymes containing the single amino acid substitution Y188L
15
Total Activities
15
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

Quinoxalinylethylpyridylthioureas (QXPTs) as potent non-nucleoside HIV-1 reverse transcriptase (RT) inhibitors. Further SAR studies and identification of a novel orally bioavailable hydrazine-based antiviral agent.
Campiani G, Aiello F, Fabbrini M, Morelli E, Ramunno A, Armaroli S, Nacci V, Garofalo A, Greco G, Novellino E, Maga G, Spadari S, Bergamini A, Ventura L, Bongiovanni B, Capozzi M, Bolacchi F, Marini S, Coletta M, Guiso G, Caccia S.
J Med Chem (2001) 44 : 305 -315
PubMed 11462972 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
Ki 15 6.13 7.00

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL105976 1 7.00
CHEMBL107535 1 6.89
CHEMBL105916 1 6.70
CHEMBL107099 1 6.70
CHEMBL223228 EFAVIRENZ 4.0 1 6.52
CHEMBL107342 1 6.40
CHEMBL316514 1 6.35
CHEMBL418833 1 6.16
CHEMBL110091 1 6.05
CHEMBL418812 1 5.92
CHEMBL317406 1 5.82
CHEMBL322698 1 5.75
CHEMBL108221 1 5.60
CHEMBL320557 1 5.30
CHEMBL57 NEVIRAPINE 4.0 1 4.75

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL105976 Ki = 100.0 nM 7.00
CHEMBL107535 Ki = 130.0 nM 6.89
CHEMBL105916 Ki = 200.0 nM 6.70
CHEMBL107099 Ki = 200.0 nM 6.70
CHEMBL223228 EFAVIRENZ Ki = 300.0 nM 6.52
CHEMBL107342 Ki = 400.0 nM 6.40
CHEMBL316514 Ki = 450.0 nM 6.35
CHEMBL418833 Ki = 700.0 nM 6.16
CHEMBL110091 Ki = 900.0 nM 6.05
CHEMBL418812 Ki = 1200.0 nM 5.92
CHEMBL317406 Ki = 1500.0 nM 5.82
CHEMBL322698 Ki = 1800.0 nM 5.75
CHEMBL108221 Ki = 2500.0 nM 5.60
CHEMBL320557 Ki = 5000.0 nM 5.30
CHEMBL57 NEVIRAPINE Ki = 18000.0 nM 4.75