Can BDDCS illuminate targets in drug design?

Abstract:

:The fact that pharmacokinetic (PK) properties of drugs influence their interaction with protein targets is a principle known for decades. The same cannot be said for the opposite, namely that targets influence the PK properties of drugs. Evidence confirming this possibility is introduced here for the first time, as we show that certain protein families have a clear preference for drugs with specific PK properties. We investigate this by cross-referencing 'druggable target' annotations for >1000 US Food and Drug Administration (FDA)-approved drugs with their PK profile, as defined by the Biopharmaceutics Drug Disposition Classification System (BDDCS) criteria, and then examine the BDDCS preference for several major target protein families and therapeutic categories. Our findings suggest a novel way to conduct drug discovery by focusing PK profiles at the very early stage of target selection.

journal_name

Drug Discov Today

journal_title

Drug discovery today

authors

Bocci G,Benet LZ,Oprea TI

doi

10.1016/j.drudis.2019.09.021

subject

Has Abstract

pub_date

2019-12-01 00:00:00

pages

2299-2306

issue

12

eissn

1359-6446

issn

1878-5832

pii

S1359-6446(19)30381-2

journal_volume

24

pub_type

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