Prioritizing Small Sets of Molecules for Synthesis through in-silico Tools: A Comparison of Common Ranking Methods.

Authors:
Breznik M; Ge Y; Bluck JP; Briem H; Hahn DF and 4 more

Journal:
ChemMedChem

Publication Year: 2022

DOI:
10.1002/cmdc.202200425

PMCID:
PMC9868080

PMID:
36240514

Journal Information

Full Title: ChemMedChem

Abbreviation: ChemMedChem

Country: Unknown

Publisher: Unknown

Language: N/A

Publication Details

Subject Category: Pharmacology

Available in Europe PMC: Yes

Available in PMC: Yes

PDF Available: No

Transparency Score
3/6
50.0% Transparent
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Evidence found in paper:

"Conflict of interest J.P.B., H.B., C.D.C., J.M., and K.M. are employees of Bayer AG. Furthermore, K.M. and C.D.C. are shareholders of Bayer AG. D.F.H. is an employee of Janssen. D.L.M. is a member of the Scientific Advisory Board of OpenEye Scientific Software and an Open Science Fellow with Roivant."

Evidence found in paper:

"D.L.M. and Y.G. appreciate financial support from the National Institutes of Health (R01GM108889). The authors would like to thank Daniel Hillebrand O′ Donovan and Volker Schulze for proof‐reading the manuscript and helpful discussions."

Protocol Registration
Open Access
Paper is freely available to read
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Assessment Info

Tool: rtransparent

OST Version: N/A

Last Updated: Aug 05, 2025