Ontology type: schema:ScholarlyArticle Open Access: True
2019-12
AUTHORSSannah Zoffmann, Maarten Vercruysse, Fethallah Benmansour, Andreas Maunz, Luise Wolf, Rita Blum Marti, Tobias Heckel, Haiyuan Ding, Hoa Hue Truong, Michael Prummer, Roland Schmucki, Clive S. Mason, Kenneth Bradley, Asha Ivy Jacob, Christian Lerner, Andrea Araujo del Rosario, Mark Burcin, Kurt E. Amrein, Marco Prunotto
ABSTRACTIdentification of novel antibiotics remains a major challenge for drug discovery. The present study explores use of phenotypic readouts beyond classical antibacterial growth inhibition adopting a combined multiparametric high content screening and genomic approach. Deployment of the semi-automated bacterial phenotypic fingerprint (BPF) profiling platform in conjunction with a machine learning-powered dataset analysis, effectively allowed us to narrow down, compare and predict compound mode of action (MoA). The method identifies weak antibacterial hits allowing full exploitation of low potency hits frequently discovered by routine antibacterial screening. We demonstrate that BPF classification tool can be successfully used to guide chemical structure activity relationship optimization, enabling antibiotic development and that this approach can be fruitfully applied across species. The BPF classification tool could be potentially applied in primary screening, effectively enabling identification of novel antibacterial compound hits and differentiating their MoA, hence widening the known antibacterial chemical space of existing pharmaceutical compound libraries. More generally, beyond the specific objective of the present work, the proposed approach could be profitably applied to a broader range of diseases amenable to phenotypic drug discovery. More... »
PAGES5013
http://scigraph.springernature.com/pub.10.1038/s41598-019-39387-9
DOIhttp://dx.doi.org/10.1038/s41598-019-39387-9
DIMENSIONShttps://app.dimensions.ai/details/publication/pub.1112900491
PUBMEDhttps://www.ncbi.nlm.nih.gov/pubmed/30899034
JSON-LD is the canonical representation for SciGraph data.
TIP: You can open this SciGraph record using an external JSON-LD service: JSON-LD Playground Google SDTT
[
{
"@context": "https://springernature.github.io/scigraph/jsonld/sgcontext.json",
"about": [
{
"id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/0304",
"inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/",
"name": "Medicinal and Biomolecular Chemistry",
"type": "DefinedTerm"
},
{
"id": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/03",
"inDefinedTermSet": "http://purl.org/au-research/vocabulary/anzsrc-for/2008/",
"name": "Chemical Sciences",
"type": "DefinedTerm"
}
],
"author": [
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Zoffmann",
"givenName": "Sannah",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Vercruysse",
"givenName": "Maarten",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Benmansour",
"givenName": "Fethallah",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Maunz",
"givenName": "Andreas",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Wolf",
"givenName": "Luise",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Marti",
"givenName": "Rita Blum",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Heckel",
"givenName": "Tobias",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Shanghai, Shanghai, China"
],
"type": "Organization"
},
"familyName": "Ding",
"givenName": "Haiyuan",
"type": "Person"
},
{
"affiliation": {
"alternateName": "Gilead Sciences (United States)",
"id": "https://www.grid.ac/institutes/grid.418227.a",
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland",
"Gilead Sciences, San Francisco, USA"
],
"type": "Organization"
},
"familyName": "Truong",
"givenName": "Hoa Hue",
"type": "Person"
},
{
"affiliation": {
"alternateName": "Swiss Federal Institute of Technology in Zurich",
"id": "https://www.grid.ac/institutes/grid.5801.c",
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland",
"NEXUS Personalized Health Technologies, ETH Z\u00fcrich, and Swiss Institute of Bioinformatics, Z\u00fcrich, Switzerland"
],
"type": "Organization"
},
"familyName": "Prummer",
"givenName": "Michael",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Schmucki",
"givenName": "Roland",
"type": "Person"
},
{
"affiliation": {
"name": [
"Discuva Ltd, part of Summit Therapeutics, Merrifield Centre, Cambridge, UK"
],
"type": "Organization"
},
"familyName": "Mason",
"givenName": "Clive S.",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Bradley",
"givenName": "Kenneth",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Jacob",
"givenName": "Asha Ivy",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Lerner",
"givenName": "Christian",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "del Rosario",
"givenName": "Andrea Araujo",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Burcin",
"givenName": "Mark",
"type": "Person"
},
{
"affiliation": {
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Amrein",
"givenName": "Kurt E.",
"type": "Person"
},
{
"affiliation": {
"alternateName": "Roche (Switzerland)",
"id": "https://www.grid.ac/institutes/grid.417570.0",
"name": [
"Roche Pharmaceutical Research and Early Development, Roche Innovation Center Basel, Basel, Switzerland",
"School of Pharmaceutical Sciences, University of Geneva, Geneva, Switzerland",
"I2O Office of Innovation, Roche and Genentech Late Stage Development, Hoffmann-La Roche AG, Basel, Switzerland"
],
"type": "Organization"
},
"familyName": "Prunotto",
"givenName": "Marco",
"type": "Person"
}
],
"citation": [
{
"id": "https://doi.org/10.1128/cmr.00030-10",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1006875263"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1128/jb.02552-14",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1006992008"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1002/sim.4780110717",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1007388238"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1038/msb4100050",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1007788508"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1038/msb4100050",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1007788508"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1371/journal.pone.0084409",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1008283180"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1021/ar500432k",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1009882122"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.4155/fmc-2016-0029",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1013382126"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1016/j.drudis.2013.07.001",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1013478546"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1126/science.1106753",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1013829912"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1038/ng1348",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1014032790",
"https://doi.org/10.1038/ng1348"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1038/ng1348",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1014032790",
"https://doi.org/10.1038/ng1348"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1126/science.1058758",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1019023475"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1023/a:1010933404324",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1024739340",
"https://doi.org/10.1023/a:1010933404324"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1128/aac.02019-15",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1025067609"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1093/bioinformatics/btq057",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1025260149"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1093/nar/gks1235",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1029541161"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1074/jbc.274.16.11110",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1029583815"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1021/ci9800211",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1029804823"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1021/ci9800211",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1029804823"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1053/j.spid.2004.02.001",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1029987806"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1038/nature17042",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1038585164",
"https://doi.org/10.1038/nature17042"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1128/aac.46.11.3549-3554.2002",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1039203004"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1038/nmeth.1226",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1045381177",
"https://doi.org/10.1038/nmeth.1226"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1074/jbc.m705274200",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1048417929"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1073/pnas.1311066110",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1051244467"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.1080/01621459.1963.10500845",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1058299788"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.18637/jss.v028.i05",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1068672403"
],
"type": "CreativeWork"
},
{
"id": "https://doi.org/10.2174/138945009787581113",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1069180748"
],
"type": "CreativeWork"
},
{
"id": "sg:pub.10.1038/ja.2017.124",
"sameAs": [
"https://app.dimensions.ai/details/publication/pub.1092474999",
"https://doi.org/10.1038/ja.2017.124"
],
"type": "CreativeWork"
}
],
"datePublished": "2019-12",
"datePublishedReg": "2019-12-01",
"description": "Identification of novel antibiotics remains a major challenge for drug discovery. The present study explores use of phenotypic readouts beyond classical antibacterial growth inhibition adopting a combined multiparametric high content screening and genomic approach. Deployment of the semi-automated bacterial phenotypic fingerprint (BPF) profiling platform in conjunction with a machine learning-powered dataset analysis, effectively allowed us to narrow down, compare and predict compound mode of action (MoA). The method identifies weak antibacterial hits allowing full exploitation of low potency hits frequently discovered by routine antibacterial screening. We demonstrate that BPF classification tool can be successfully used to guide chemical structure activity relationship optimization, enabling antibiotic development and that this approach can be fruitfully applied across species. The BPF classification tool could be potentially applied in primary screening, effectively enabling identification of novel antibacterial compound hits and differentiating their MoA, hence widening the known antibacterial chemical space of existing pharmaceutical compound libraries. More generally, beyond the specific objective of the present work, the proposed approach could be profitably applied to a broader range of diseases amenable to phenotypic drug discovery.",
"genre": "research_article",
"id": "sg:pub.10.1038/s41598-019-39387-9",
"inLanguage": [
"en"
],
"isAccessibleForFree": true,
"isPartOf": [
{
"id": "sg:journal.1045337",
"issn": [
"2045-2322"
],
"name": "Scientific Reports",
"type": "Periodical"
},
{
"issueNumber": "1",
"type": "PublicationIssue"
},
{
"type": "PublicationVolume",
"volumeNumber": "9"
}
],
"name": "Machine learning-powered antibiotics phenotypic drug discovery",
"pagination": "5013",
"productId": [
{
"name": "readcube_id",
"type": "PropertyValue",
"value": [
"b3fb4f93a5d20c70207e6c68ff74c5c7d6ce64f7f495354a5db5ed91e95f6bef"
]
},
{
"name": "pubmed_id",
"type": "PropertyValue",
"value": [
"30899034"
]
},
{
"name": "nlm_unique_id",
"type": "PropertyValue",
"value": [
"101563288"
]
},
{
"name": "doi",
"type": "PropertyValue",
"value": [
"10.1038/s41598-019-39387-9"
]
},
{
"name": "dimensions_id",
"type": "PropertyValue",
"value": [
"pub.1112900491"
]
}
],
"sameAs": [
"https://doi.org/10.1038/s41598-019-39387-9",
"https://app.dimensions.ai/details/publication/pub.1112900491"
],
"sdDataset": "articles",
"sdDatePublished": "2019-04-11T13:19",
"sdLicense": "https://scigraph.springernature.com/explorer/license/",
"sdPublisher": {
"name": "Springer Nature - SN SciGraph project",
"type": "Organization"
},
"sdSource": "s3://com-uberresearch-data-dimensions-target-20181106-alternative/cleanup/v134/2549eaecd7973599484d7c17b260dba0a4ecb94b/merge/v9/a6c9fde33151104705d4d7ff012ea9563521a3ce/jats-lookup/v90/0000000368_0000000368/records_78950_00000001.jsonl",
"type": "ScholarlyArticle",
"url": "https://www.nature.com/articles/s41598-019-39387-9"
}
]
Download the RDF metadata as: json-ld nt turtle xml License info
JSON-LD is a popular format for linked data which is fully compatible with JSON.
curl -H 'Accept: application/ld+json' 'https://scigraph.springernature.com/pub.10.1038/s41598-019-39387-9'
N-Triples is a line-based linked data format ideal for batch operations.
curl -H 'Accept: application/n-triples' 'https://scigraph.springernature.com/pub.10.1038/s41598-019-39387-9'
Turtle is a human-readable linked data format.
curl -H 'Accept: text/turtle' 'https://scigraph.springernature.com/pub.10.1038/s41598-019-39387-9'
RDF/XML is a standard XML format for linked data.
curl -H 'Accept: application/rdf+xml' 'https://scigraph.springernature.com/pub.10.1038/s41598-019-39387-9'
This table displays all metadata directly associated to this object as RDF triples.
303 TRIPLES
21 PREDICATES
56 URIs
21 LITERALS
9 BLANK NODES