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- W2292290046 abstract "On the basis of a crystal structure of a phenylpyrrolidine lead and subsequent molecular modeling results, we designed and synthesized a novel series of macrocyclic FVIIa inhibitors. The optimal 16-membered macrocycle was 60-fold more potent than an acyclic analog. Further potency optimization by incorporation of P1' alkyl sulfone and P2 methyl groups provided a macrocycle with TF/FVIIa Ki = 1.6 nM, excellent selectivity against a panel of seven serine proteases, and FVII-deficient prothrombin time EC2x = 1.2 μM. Discovery of this potent, selective macrocyclic scaffold opens new possibilities for the development of orally bioavailable FVIIa inhibitors." @default.
- W2292290046 created "2016-06-24" @default.
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- W2292290046 date "2015-07-28" @default.
- W2292290046 modified "2023-09-24" @default.
- W2292290046 title "Structure-Based Design of Macrocyclic Coagulation Factor VIIa Inhibitors" @default.
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- W2292290046 doi "https://doi.org/10.1021/acs.jmedchem.5b00788" @default.
- W2292290046 hasPubMedId "https://pubmed.ncbi.nlm.nih.gov/26151189" @default.
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