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List of online chemical databases used for pharmacophore search.

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资源简介：

List of online chemical databases used for pharmacophore search.

应用场景：

创建时间：

2023-08-24

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受精抑制剂开发

Combined hormone drugs are the basis for orally administered contraception. However, they are associated with severe side effects that are even more impactful for women in developing countries, where

NIAID Data Ecosystem110

In silico drug screen reveals potential competitive MTHFR inhibitors for clinical repurposing

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MTHFR (Methylenetetrahydrofolate reductase) is a pivotal enzyme involved in one-carbon metabolism, which is critical for the proliferation of cancer cells. In line with this, published literature show

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Targeting the Binding Function 3 (BF3) Site of the Human Androgen Receptor through Virtual Screening.

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前列腺癌靶向治疗

The androgen receptor (AR) is the best studied drug target for the treatment of prostate cancer. While there are a number of drugs that target the AR, they all work through the same mechanism of actio

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Discovery of Novel Potent Reversible and Irreversible Myeloperoxidase Inhibitors Using Virtual Screening Procedure

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糖苷酶抑制剂

The heme enzyme myeloperoxidase (MPO) participates in innate immune defense mechanism through formation of microbicidal reactive oxidants. However, evidence has emerged that MPO-derived oxidants contr

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Bioactivity score of Ph-triazole predicted from Molinspiration database.

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生化性质预测

Bioactivity score of Ph-triazole predicted from Molinspiration database.

Figshare2025-12-09 更新10