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Assay Detail

CHEMBL1033992

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Functional
Antiviral activity against Herpes simplex virus 1
ChEMBL ↗
48
Total Activities
47
Compounds Tested
1
Activity Types
0
Assay Parameters

Assay Information

Assay Type Functional
Organism Human alphaherpesvirus 1
Confidence 1 — Organism
Curated By Autocuration

Target

Human alphaherpesvirus 1 (CHEMBL377) ↗
Type ORGANISM
Organism Human alphaherpesvirus 1

Publication

Unified QSAR approach to antimicrobials. 4. Multi-target QSAR modeling and comparative multi-distance study of the giant components of antiviral drug-drug complex networks.
Prado-Prado FJ, Martinez de la Vega O, Uriarte E, Ubeira FM, Chou KC, González-Díaz H.
Bioorg Med Chem (2009) 17 : 569 -575
PubMed 19112024 · DOI

Activity Statistics

Type Count Avg pChEMBL Best pChEMBL
IC50 48 8.49 10.62

Compounds Tested

Compound Name Phase Activities Best pChEMBL
CHEMBL484 ADEFOVIR 3.0 1 10.62
CHEMBL298845 — — 1 10.61
CHEMBL504793 — — 2 10.60
CHEMBL301240 — — 1 10.28
CHEMBL57548 — — 1 9.98
CHEMBL56641 — — 1 9.22
CHEMBL59520 — — 1 9.10
CHEMBL57384 — — 1 9.00
CHEMBL299704 — — 1 8.96
CHEMBL148716 — — 1 8.92
CHEMBL356695 — — 1 8.92
CHEMBL149664 — — 1 8.92
CHEMBL146182 — — 1 8.92
CHEMBL358153 — — 1 8.92
CHEMBL149197 — — 1 8.92
CHEMBL356135 — — 1 8.92
CHEMBL356437 — — 1 8.92
CHEMBL148304 — — 1 8.92
CHEMBL150124 — — 1 8.92
CHEMBL150057 — — 1 8.92
CHEMBL146699 — — 1 8.92
CHEMBL149116 — — 1 8.92
CHEMBL342983 — — 1 8.92
CHEMBL57452 — — 1 8.92
CHEMBL146197 — — 1 8.92
CHEMBL58026 — — 1 8.86
CHEMBL59144 — — 1 8.85
CHEMBL58370 — — 1 8.79
CHEMBL298597 — — 1 8.62
CHEMBL56723 — — 1 8.59

Activity Data

Compound Name Type Rel. Value Units pChEMBL
CHEMBL484 ADEFOVIR IC50 = 0.024 nM 10.62
CHEMBL298845 — IC50 = 0.02462 nM 10.61
CHEMBL504793 — IC50 = 0.025 nM 10.60
CHEMBL504793 — IC50 = 0.03623 nM 10.44
CHEMBL301240 — IC50 = 0.05263 nM 10.28
CHEMBL57548 — IC50 = 0.1036 nM 9.98
CHEMBL56641 — IC50 = 0.5955 nM 9.22
CHEMBL59520 — IC50 = 0.7895 nM 9.10
CHEMBL57384 — IC50 = 0.9926 nM 9.00
CHEMBL299704 — IC50 = 1.099 nM 8.96
CHEMBL150057 — IC50 = 1.2 nM 8.92
CHEMBL356695 — IC50 = 1.2 nM 8.92
CHEMBL356135 — IC50 = 1.2 nM 8.92
CHEMBL149664 — IC50 = 1.2 nM 8.92
CHEMBL146182 — IC50 = 1.2 nM 8.92
CHEMBL150124 — IC50 = 1.2 nM 8.92
CHEMBL148304 — IC50 = 1.2 nM 8.92
CHEMBL356437 — IC50 = 1.2 nM 8.92
CHEMBL358153 — IC50 = 1.2 nM 8.92
CHEMBL146197 — IC50 = 1.2 nM 8.92
CHEMBL146699 — IC50 = 1.2 nM 8.92
CHEMBL149116 — IC50 = 1.2 nM 8.92
CHEMBL342983 — IC50 = 1.2 nM 8.92
CHEMBL57452 — IC50 = 1.201 nM 8.92
CHEMBL148716 — IC50 = 1.2 nM 8.92
CHEMBL149197 — IC50 = 1.2 nM 8.92
CHEMBL58026 — IC50 = 1.37 nM 8.86
CHEMBL59144 — IC50 = 1.423 nM 8.85
CHEMBL58370 — IC50 = 1.606 nM 8.79
CHEMBL298597 — IC50 = 2.41 nM 8.62
CHEMBL56723 — IC50 = 2.597 nM 8.59
CHEMBL146673 (NORTH)-METHANOCARBATHYMIDINE IC50 = 120.0 nM 6.92
CHEMBL413063 — IC50 = 1230.0 nM 5.91
CHEMBL146350 — IC50 = 6410.0 nM 5.19
CHEMBL291331 — IC50 = 6430.0 nM 5.19
CHEMBL364765 — IC50 = 8000.0 nM 5.10
CHEMBL186389 — IC50 = 18000.0 nM 4.75
CHEMBL31634 BRIVUDINE IC50 = 48000.0 nM 4.32
CHEMBL347817 — IC50 = 380000.0 nM -
CHEMBL344107 — IC50 = 275000.0 nM -
CHEMBL189399 — IC50 = 120000.0 nM -
CHEMBL421982 — IC50 = 420000.0 nM -
CHEMBL265948 FILOCICLOVIR IC50 = 380000.0 nM -
CHEMBL151794 — IC50 = 448000.0 nM -
CHEMBL157102 — IC50 = 404000.0 nM -
CHEMBL152335 — IC50 = 381000.0 nM -
CHEMBL513554 — IC50 = 361000.0 nM -
CHEMBL346387 — IC50 = 0.0048 nM -