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• W2013091037 abstract "An efficient process for the discovery of inhibitors of DDAH enzymes, without the requirement for high throughput screening, is described. Physicochemical filtering of a 308,000-compound library according to drug likeness followed by reciprocal nearest neighbour selection produced a representative subset of 35,000 compounds. Virtual screening on a dual processor PC using FlexX, followed by biological screening, identified two hit series. Similarity searches of commercial databases and chemical re-synthesis of pure compounds resulted in SR445 as an inhibitor of Pseudomonas aeruginosa DDAH at 2 microM." @default.
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• W2013091037 date "2007-07-01" @default.
• W2013091037 modified "2023-09-25" @default.
• W2013091037 title "Discovery of inhibitors of the pentein superfamily protein dimethylarginine dimethylaminohydrolase (DDAH), by virtual screening and hit analysis" @default.
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• W2013091037 doi "https://doi.org/10.1016/j.bmcl.2007.04.095" @default.
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