The ChEMBL database in 2017

Pharos: Collating protein information to shed light on the druggable genome

(2016) Dac-Trung Nguyen et al.   NUCLEIC ACIDS RESEARCH

Open Targets: a platform for therapeutic target identification and validation

(2016) Gautier Koscielny et al.   NUCLEIC ACIDS RESEARCH

PubChem BioAssay: 2017 update

(2016) Yanli Wang et al.   NUCLEIC ACIDS RESEARCH

A drug target slim: using gene ontology and gene ontology annotations to navigate protein-ligand target space in ChEMBL

(2016) Prudence Mutowo et al.   Journal of Biomedical Semantics

Activity, assay and target data curation and quality in the ChEMBL database

(2015) George Papadatos et al.   JOURNAL OF COMPUTER-AIDED MOLECULAR DESIGN

An analysis of the attrition of drug candidates from four major pharmaceutical companies

(2015) Michael J. Waring et al.   NATURE REVIEWS DRUG DISCOVERY

SureChEMBL: a large-scale, chemically annotated patent document database

(2015) George Papadatos et al.   NUCLEIC ACIDS RESEARCH

WITHDRAWN—a resource for withdrawn and discontinued drugs

(2015) Vishal B. Siramshetty et al.   NUCLEIC ACIDS RESEARCH

ChEMBL web services: streamlining access to drug discovery data and utilities

(2015) Mark Davies et al.   NUCLEIC ACIDS RESEARCH

The Transporter Classification Database (TCDB): recent advances

(2015) Milton H. Saier et al.   NUCLEIC ACIDS RESEARCH

BindingDB in 2015: A public database for medicinal chemistry, computational chemistry and systems pharmacology

(2015) Michael K. Gilson et al.   NUCLEIC ACIDS RESEARCH

canSAR: an updated cancer research and drug discovery knowledgebase

(2015) Joseph E. Tym et al.   NUCLEIC ACIDS RESEARCH

The IUPHAR/BPS Guide to PHARMACOLOGY in 2016: towards curated quantitative interactions between 1300 protein targets and 6000 ligands

(2015) Christopher Southan et al.   NUCLEIC ACIDS RESEARCH

A large-scale crop protection bioassay data set

(2015) Anna Gaulton et al.   Scientific Data

Clinical development success rates for investigational drugs

(2014) Michael Hay et al.   NATURE BIOTECHNOLOGY

Lessons learned from the fate of AstraZeneca's drug pipeline: a five-dimensional framework

(2014) David Cook et al.   NATURE REVIEWS DRUG DISCOVERY

UniChem: extension of InChI-based compound mapping to salt, connectivity and stereochemistry layers

(2014) Jon Chambers et al.   Journal of Cheminformatics

Evolving BioAssay Ontology (BAO): modularization, integration and applications

(2014) Saminda Abeyruwan et al.   Journal of Biomedical Semantics

CLO: The cell line ontology

(2014) Sirarat Sarntivijai et al.   Journal of Biomedical Semantics

myChEMBL: a virtual machine implementation of open data and cheminformatics tools

(2013) R. Ochoa et al.   BIOINFORMATICS

ChromoHub V2: cancer genomics

(2013) Muhammad A. Shah et al.   BIOINFORMATICS

BeCAS: biomedical concept recognition services and visualization

(2013) T. Nunes et al.   BIOINFORMATICS

Phase II and Phase III attrition rates 2011–2012

(2013) John Arrowsmith et al.   NATURE REVIEWS DRUG DISCOVERY

The ChEMBL bioactivity database: an update

(2013) A. Patrícia Bento et al.   NUCLEIC ACIDS RESEARCH

The Open Access Malaria Box: A Drug Discovery Catalyst for Neglected Diseases

(2013) Thomas Spangenberg et al.   PLoS One

How to access and process FDA drug approval packages for use in research

(2013) E. H. Turner   BMJ-British Medical Journal

Open PHACTS: semantic interoperability for drug discovery

(2012) Antony J. Williams et al.   DRUG DISCOVERY TODAY

Modern Phenotypic Drug Discovery Is a Viable, Neoclassic Pharma Strategy

(2012) Jonathan A. Lee et al.   JOURNAL OF MEDICINAL CHEMISTRY

The Units Ontology: a tool for integrating units of measurement in science

(2012) G. V. Gkoutos et al.   Database-The Journal of Biological Databases and Curation

Uberon, an integrative multi-species anatomy ontology

(2012) Christopher J Mungall et al.   GENOME BIOLOGY

BioAssay Ontology (BAO): a semantic description of bioassays and high-throughput screening results

(2011) Ubbo Visser et al.   BMC BIOINFORMATICS

Can the flow of medicines be improved? Fundamental pharmacokinetic and pharmacological principles toward improving Phase II survival

(2011) Paul Morgan et al.   DRUG DISCOVERY TODAY

Drugs for Neglected Diseasesinitiativemodel of drug development for neglected diseases: current status and future challenges

(2011) Jean-Robert Ioset et al.   Future Medicinal Chemistry

Carnitine Palmitoyltransferase (CPT) Modulators: A Medicinal Chemistry Perspective on 35 Years of Research

(2011) Simona M. Ceccarelli et al.   JOURNAL OF MEDICINAL CHEMISTRY

Getting pharmaceutical R&D back on target

(2011) Mark E Bunnage   Nature Chemical Biology

ChEMBL: a large-scale bioactivity database for drug discovery

(2011) A. Gaulton et al.   NUCLEIC ACIDS RESEARCH

Open Babel: An open chemical toolbox

(2011) Noel M O'Boyle et al.   Journal of Cheminformatics

Modeling sample variables with an Experimental Factor Ontology

(2010) James Malone et al.   BIOINFORMATICS

New Substructure Filters for Removal of Pan Assay Interference Compounds (PAINS) from Screening Libraries and for Their Exclusion in Bioassays

(2010) Jonathan B. Baell et al.   JOURNAL OF MEDICINAL CHEMISTRY

Thousands of chemical starting points for antimalarial lead identification

(2010) Francisco-Javier Gamo et al.   NATURE

The BRENDA Tissue Ontology (BTO): the first all-integrating ontology of all organisms for enzyme sources

(2010) M. Gremse et al.   NUCLEIC ACIDS RESEARCH

Optical Structure Recognition Software To Recover Chemical Information: OSRA, An Open Source Solution

(2009) Igor V. Filippov et al.   Journal of Chemical Information and Modeling

A Kernel for Open Source Drug Discovery in Tropical Diseases

(2009) Leticia Ortí et al.   PLoS Neglected Tropical Diseases

Lessons Learnt from Assembling Screening Libraries for Drug Discovery for Neglected Diseases

(2007) Ruth Brenk et al.   ChemMedChem