WhichCyp: prediction of cytochromes P450 inhibition

TY - JOUR

T1 - WhichCyp

T2 - prediction of cytochromes P450 inhibition

AU - Rostkowski, Michal

AU - Spjuth, Ola

AU - Rydberg, Patrik

PY - 2013/8/15

Y1 - 2013/8/15

N2 - In this work we present WhichCyp, a tool for prediction of which cytochromes P450 isoforms (among 1A2, 2C9, 2C19, 2D6 and 3A4) a given molecule is likely to inhibit. The models are built from experimental high-throughput data using support vector machines and molecular signatures.Availability: The WhichCyp server is freely available for use on the web at http://drug.ku.dk/ whichcyp, where the WhichCyp Java program and source code is also available for download.Contact: Supplementary information: Supplementary data are available at Bioinformatics online.

AB - In this work we present WhichCyp, a tool for prediction of which cytochromes P450 isoforms (among 1A2, 2C9, 2C19, 2D6 and 3A4) a given molecule is likely to inhibit. The models are built from experimental high-throughput data using support vector machines and molecular signatures.Availability: The WhichCyp server is freely available for use on the web at http://drug.ku.dk/ whichcyp, where the WhichCyp Java program and source code is also available for download.Contact: Supplementary information: Supplementary data are available at Bioinformatics online.

U2 - 10.1093/bioinformatics/btt325

DO - 10.1093/bioinformatics/btt325

M3 - Journal article

C2 - 23740742

SN - 1367-4803

VL - 29

SP - 2051

EP - 2052

JO - Bioinformatics

JF - Bioinformatics

IS - 16

ER -