Projects

Find here machine learning exercises published by drTarget so far.

Select phenotypic or target based screens

Latest effort! GLP-1 receptor positive allosteric modulators

Go to GLP-1 receptor positive allosteric modulators dataset

Wilbon & Kolonin. GLP1 Receptor Agonists-Effects beyond Obesity and Diabetes.

Phenotypic effect of predicted GLP1R positive allosteric modulators

additional machine learning studies

SMN2 for Spinal Muscular Atrophy

By Emw (Own work) [CC BY-SA 3.0 (https://creativecommons.org/licenses/by-sa/3.0) or GFDL (http://www.gnu.org/copyleft/fdl.html)], via Wikimedia Commons

SARS-COVID-19

By We Are Covert – We Are Covert, Copyrighted free use

Breast Cancer

MCF-7 breast cancer cell line (By Ian P Newton & Paul L Appleton – Own work, CC BY-SA 4.0, https://commons.wikimedia.org/w/index.php?curid=45221234)

P53 expression modulators

P53 DNA binding domain By Jawahar Swaminathan and MSD staff at the European Bioinformatics Institute [Public domain], via Wikimedia Commons

Augmenter of liver regeneration ALR for fibrosis and cancer

By Jawahar Swaminathan and MSD staff at the European Bioinformatics Institute – http://www.ebi.ac.uk/pdbe-srv/view/images/entry/1oqc600.png, displayed on http://www.ebi.ac.uk/pdbe-srv/view/entry/1oqc/summary, Public Domain, https://commons.wikimedia.org/w/index.php?curid=5902148

Cytotoxicity

drTarget portfolio is composed of 105 programs suitable for machine learning

on the basis of the amount of information available in ChEMBL & PChem.

See drTarget programs: assay type vs disease & therapeutic area.

Colors, sizes and shapes based on tractability and type of study as described in legend.

drTarget portfolio treeMap hierarchizez by therapeutic area, disease and target.

Colors and sizes based on tractability as described in legend.

20 out of 105 programs have completed virtual screenings, followed by subsequent network analysis.

Four more programs show promising prospective analytics.

Access to full drTargetPortfolio

check programs in drTarget portfolio table

area	disease	program	assay	assayType	assayMode	addTasks	level	tractability	PoC	MLmodels	virtualScreening	TID/assayID	pathwaysAnalysis	graphsGeneration	literatureCheck	webPublication
cancer	breast cancer	BrCa cell lines	8 cell line screens at ChEMBL	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	underway	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	breast cancer	BRCA1 activation	qHTS Assay to Identify Small Molecule Activators of BRCA1 Expression	expressionReporter	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	breast cancer	BrCaAvg	avg of cell line screens at ChEMBL	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	completed	completed
cancer	cancer	AKT1 phosphorylation	HTS Assay for Inhibitors of Akt Phophorylation: Primary Screen	phosphorylation-HTRF	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	cancer	ALR inhibitors	HTS-Luminescent assay for inhibitors of ALR by detection of hydrogen peroxide production Measured in Biochemical System Using Plate Reader - 2036-02_Inhibitor_SinglePoint_HTS	enzymeAct	target-based	assayID	3	virtual screening, assayID, pathway analysis and repurposing completed	completed	completed	completed	completed	notApplicable	completed	started	notStarted
cancer	cancer	ATAD5	qHTS screen for small molecules that inhibit ELG1-dependent DNA repair in human embryonic kidney (HEK293T) cells expressing luciferase-tagged ELG1	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	underway
cancer	cancer	HSP90AA1	Luminescence-based primary biochemical high throughput screening assay to identify inhibitors of the Heat Shock Protein 90 (HSP90)	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	cancer	Nrf2 inhibitors	Nrf2 qHTS screen for inhibitors	expressionReporter	target-based	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	notStarted
cancer	cancer	P53	qHTS assay for re-activators of p53 using a Luc reporter	expressionReporter	target-based	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	completed
cancer	cancer	Peg3	HTS Assay for Peg3 Promoter Inhibitors	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	cancer, poor prognosis EGFR overexpressing tumours	ADAM17	QFRET-based biochemical primary high throughput screening assay to identify exosite inhibitors of ADAM17.	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	colon cancer	CoCa cell lines	9 cell line screens at ChEMBL	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	underway	underway	underway	underway
cancer	leukemia	Menin-MLL	qHTS Assay for Inhibitors Targeting the Menin-MLL Interaction in MLL Related Leukemias: Competition With Texas Red Labeled MLL-derived Mutant Peptide	PPI	target-based	assayID	2	prospective analytics successful	completed	completed	completed	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	leukemia	myeloid differentiation	HTS to identify compounds that promote myeloid differentiation with MLPCN compound set	expressionReporter	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	lung cancer	LuCa cell lines	11 cell line screens at ChEMBL	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway
cancer	melanoma	MITF inhibitors	AlphaScreen-based biochemical high throughput primary assay to identify inhibitors of microphthalmia-associated transcriptionfactor (MITF)	alphaScreen	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cancer	Reactivate the silenced genes in cancer cells	MBD2	TRFRET-based biochemical primary high throughput screening assay to identify inhibitors of 5-meCpG-binding domain protein 2 (MBD2)-DBD binding to methylated oligonucleotide	FRET binding	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cellMechanisms	autophagy	ATG4B	uHTS fluorescent assay for identification of inhibitors of ATG4B	enzymeAct	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cellMechanisms	autophagy	autophagy imaging assay	High-content cell-based screening for modulators of autophagy	imaging localization	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway
cellMechanisms	cytotoxicity	cytotox	cell growth assays at ChEMBL	cellGrowth	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	completed
cellMechanisms	epigenetics	bromodomain AZ2B	qHTS Assay for Inhibitors of BAZ2B	alphaScreen	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cellMechanisms	epigenetics	E92 histone-lys N-methyltransferase 2	qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a	alphaScreen	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cellMechanisms	epigenetics	Jmjd2a	qHTS Assay for Inhibitors of JMJD2A-Tudor Domain	alphaScreen	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
cellMechanisms	Lipid transport	Scarb1	HTS using DiI-HDL to assay lipid transfer in ldlA[SR-BI] cells Measured in Cell-Based System Using Plate Reader - 2085-01_Inhibitor_SinglePoint_HTS_Activity	uptake	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	autoimmune disorders	Rorc	qHTS for inhibitors of ROR gamma transcriptional activity	expressionReporter	target-based	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	completed	notStarted
immune	autoimmune disorders	Rorc	qHTS assay to identify small molecule antagonists of the retinoid-related orphan receptor gamma (ROR-gamma) signaling pathway	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	COPD	Antioxidant Response Element	qHTS assay for small molecule agonists of the antioxidant response element (ARE) signaling pathway: Summary	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	COPD	Nrf2 activators	qHTS of Nrf2 Activators	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	Lung Fibroblast Proliferation	Human Lung Fibroblast Proliferation Assay	proliferation	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	ALR activators	HTS-Luminescent assay for inhibitors of ALR by detection of hydrogen peroxide production Measured in Biochemical System Using Plate Reader - 2036-02_Inhibitor_SinglePoint_HTS	enzymeAct	target-based	assayID	3	virtual screening, assayID, pathway analysis and repurposing completed	completed	completed	completed	completed	notApplicable	notStarted	notStarted	notStarted
immune	fibrosis	MSRA	Absorbance-based biochemical primary high throughput screening assay to identify activators of Methionine sulfoxide reductase A (MsrA)	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	NCF1	uHTS of small molecular inhibitors for p47phox, a regulatory protein of NADPH oxidases (Noxs) NADPH oxidases regulatory protein	bindingFP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	relaxin agonists	qHTS Assay for Agonists of the Relaxin Receptor RXFP1	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	relaxin PMs	qHTS Assay for Antagonists of the Relaxin Receptor RXFP1 Taking the negative queue for PMs	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	SMAD3	HTS of Smad transcription factor inhibitors	bindingFRET	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	fibrosis	TGF-b	qHTS for Inhibitors of TGF-b	GFP ligand internalization	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	immunomodulation	CTL granule exocytosis	Flow Cytometric HTS Screening for Inhibitors of Lytic Granule Exocytosis with MLPCN Compound Library	CTL granule exocytosis	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	immunomodulation	STAT1 activation	Primary cell-based high throughput screening assay to measure STAT1 activation	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	immunomodulation	STAT3 activation	Primary cell-based high throughput screening assay to measure STAT3 activation	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	immunomodulation	STAT3 inhibition	Primary cell-based high throughput screening assay to measure STAT3 inhibition	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
immune	Inflammation CASP COPD	IL-1b Inflammasome	qHTS for Inhibitors of Inflammasome Signaling: IL-1-beta AlphaLISA Primary Screen	IL-1B production	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway
infectious	antibacterials	antibacterial	11 gram + & - bacterial strains at ChEMBL	cellDeath	phenotypic	TID	3	virtual screening, targetID and repurposing completed	completed	completed	completed	underway	notStarted	underway	notStarted	notStarted
infectious	antibacterials	TB	several TB strains	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway
infectious	antifungal	antifungal efflux pumps inhibitors	Phenotypic HTS multiplex for antifungal efflux pump inhibitors	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antifungal	fluconazole-resistant C.albicans	Fluorescence Cell-Based Primary HTS of C.albicans growth in the presence of Fluconazole and compound	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antifungal	tRNA 2'-phosphotransferase	Fluorescence polarization-based primary biochemical high throughput screening assay to identify inhibitors of tRNA 2'-phosphotransferase (TPT1).	enzymeAct	target-based	phenotypeID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antifungal	VMA11	HTS of Small Molecules that Regulate V-ATPase Proton Transport in Yeast using pHLuorin	pHSensitiveDye	phenotypic	TID-assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	SARS-CoV	PLP&3CLP proteasesPChem screens plus phenotypic records @ ChEMBL	proteases& cellDeath	phenotypic&targetBased	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	completed	completed
infectious	antiviral	hCMV	qHTS Assay for inhibitors of the human cytomegalovirus (HCMV)	InfectionReporter	phenotypic	TID	0	under evaluation	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	HCV inhibitors	qHTS Assay for Inhibitors of Hepatitis C Virus (HCV)	InfectionReporter	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	HIV fussion	HIV entry: Env-mediated Cell Fusion Measured in Cell-Based System Using Plate Reader - 7013-01_Inhibitor_SinglePoint_HTS_Activity	cellFussionReporter	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	NS1	Discovery of Small Molecule Probes for H1N1 Influenza NS1A	alphaScreen	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	NS1	qHTS Assay for Inhibitors of Influenza NS1 Protein Function	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	PSIP1	TRFRET-based biochemical primary high throughput screening assay to identify inhibitors of HIV-1 LEDGF/p75 DNA Integration	FRET binding	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	RSV	A Cell Based HTS Approach for the Discovery of New Inhibitors of Respiratory syncytial virus (RSV)	cellDeath	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	vif	High Throughput Screen to Identify Inhibitors Targeting HIV-1 Vif-dependent Degradation of Human APOBEC3G:#A time-resolved fluorescence resonance energy transfer (TR-FRET) assay for HIV-1 Vif-APOBEC3G interaction	FRET binding	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	antiviral	vpr	qHTS Assay for Inhibitors of the HIV-1 protein Vpr	cellDeath	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	chagas	T. Cruzi replication	Luminescence Cell-Based/Microorganism Primary HTS to Identify Inhibitors of T.Cruzi Replication	cellGrowth	phenotypic	TID	2	prospective analytics successful	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	leishmaniasis	Leishmania promastigote	Leishmania major promastigote HTS	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	P. Falciparum erythrocyte 3D7	NOVARTIS: Inhibition of Plasmodium falciparum 3D7 (drug-susceptible) proliferation in erythrocyte-based infection assay	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	P. falciparum 3d7	Inhibition of P. falciparum 3D7	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	P. falciparum Dd2	Inhibition of P. falciparum Dd2	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	P. falciparum erythrocyte W2	NOVARTIS: Inhibition of Plasmodium falciparum W2 (drug-resistant) proliferation in erythrocyte-based infection assay	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	Plasmodium cell death	Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	malaria	Plasmodium delayed death (apicoplast)	Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation	cellGrowth	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	prionDisease	PRNP	TRFRET-based cell-based primary high throughput screening assay to identify inhibitors of cell surface Prion Protein (PRPC)	expression	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	trypanosomiasis	met-tRNA synt	Luminescence-based biochemical primary high throughput screening assay to identify inhibitors of Trypanosoma brucei methionyl tRNA synthetase (MetRS)	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
infectious	trypanosomiasis	T. brucei	qHTS of Trypanosoma Brucei Inhibitors	cellDeath	phenotypic	TID	2	prospective analytics successful	completed	underway	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	Energy balance, obesity	MC4R	Luminescence-based cell-based primary high throughput screening assay to identify biased ligands of the melanocortin 4 receptor (MC4R): agonists of MC4R	bArr biased transduction	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	Energy balance, obesity	Orexin 1	FRET-based cell-based primary high throughput screening assay to identify antagonists of the orexin 1 receptor (OX1R; HCRTR1)	IP1/[Ca++]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	Energy balance, obesity	Rev-erb Alpha	uHTS identification of small molecule modulators of Rev-erb Alpha.	FP binding	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	insulin sensitization	NR2F2	Luminescence-based cell-based primary high throughput screening assay to identify inhibitors of COUP-TFII (NR2F2)	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	insulin sensitization	RXRA	qHTS assay to identify small molecule agonists of the RXR signaling pathway:	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	obesity, diabetes, and cardiovascular disease	ABHD5	Luminescence-based biochemical primary high throughput screening assay to identify inhibitors of the interaction of the lipase co-activator protein, abhydrolase domain containing 5 (ABHD5) with perilipin-5 (MLDP; PLIN5)	E.complementation PPI binding	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
metabolism	T1Diabetes	b cell apoptosis	Luminescence Cell-Based Primary HTS to Identify Inhibitors of Beta Cell Apoptosis	cellDeath	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	completed
metabolism	T2Diabetes	Glucose-dependent insulin secretion	Luminescent GLuc Reporter Gene Assay Primary HTS to Identify Small Molecule Activator of Glucose Dependent Insulin Secretion Measured in Cell-Based System Using Plate Reader - 7055-01_Activator_SinglePoint_HTS_Activity	secretion-associated reporter	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	anxiety	galanin receptor antagonists	Fluorescence-based cell-based primary high throughput screening assay to identify antagonists of the Galanin Receptor 3 (GalR3)	cAMP-coupled CNG channel: MP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	anxiety	NPS receptor antagonists	qHTS Assay for Antagonists of the Neuropeptide S Receptor: cAMP Signal Transduction	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	anxiety	NPY1 receptor antagonists	Primary cell-based high-throughput screening assay for antagonists of NPY-Y1	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	anxiety	TRH receptor enhancers	qHTS for Small Molecule Agonists and Allosteric Enhancers of Human TRH Receptor: Primary Screen for Enhancers	[Ca++]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	drug addiction	dopamine transporter	High Throughput Screening for Cocaine Antagonists: Primary Screen	uptake	target-based	assayID	2	prospective analytics successful	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	schizophrenia	D(3) dopamine receptor	qHTS of D3 Dopamine Receptor Antagonist: qHTS	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	schizophrenia	KCNH2	qHTS for Inhibitors of KCHN2 3.1: Mutant qHTS	[Tl+]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	schizophrenia	TAAR1	Fluorescence-based cell-based primary high throughput screening assay to identify agonists of the human trace amine associated receptor 1 (TAAR1)	[Ca++]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
mood disorders	schizophrenia	Wnt/Beta-catenin pathway	Wnt/Beta-catenin HTS Measured in Cell-Based System Using Plate Reader - 2161-01_Activator_SinglePoint_HTS_Activity	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	APP	Primary screen for compounds that activate Alzheimer's amyloid precursor	translation	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	APP	Primary screen for compounds that inhibit Alzheimer's amyloid precursor protein (APP) translation	translation	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	Arfgap1	Fluorescence polarization-based biochemical primary high throughput screening assay to identify inhibitors of ADP-ribosylation factor GTPase activating protein 1 (ARFGAP1)	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	CHRM4	Fluorescence-based cell-based primary high throughput screening assay to identify positive allosteric modulators (PAMs) of the human cholinergic receptor, muscarinic 4 (CHRM4)	[Ca++]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	MAPT	qHTS for Inhibitors of Tau Fibril Formation, Thioflavin T Binding	DFLINT aggregation	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	SLC5A7 choline transporter	Primary cell-based screen for identification of compounds that inhibit the Choline Transporter (CHT)	Ch-transport-coupled Na+ flow: MP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	AD	TTR	Luminescence-based cell-based primary high throughput screening assay to identify activators of Transthyretin (TTR) transcription	transcription	phenotypic	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	ALS	TDP-43	qHTS of TDP-43 Inhibitors	yeastReporter	target-based	TID	3	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	ALS, AD, neurodegeneration	mPTP	uHTS identification of small molecule inhibitors of the mitochondrial permeability transition pore via an absorbance assay	absorbance swelling	target-based	TID	2	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	ALS, AD, neurodegeneration	NFKB1	High Throughput Screen to Identify Compounds that increase expression of NF-kB in Human Neuronal Cells - Primary Screen	expressionReporter	target-based	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	notStarted
neurodegeneration	ALS, AD, neurodegeneration	P97 ATPase	Primary biochemical high-throughput screening assay to measure P97 ATPase inhibition	enzymeAct	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	HD, AD, PD, ALS, neurodegeneration	Heat shock 70kDa protein 1A	Primary cell-based high-throughput screening assay to identify transcriptional activators of heat shock protein 70 (Hsp70)	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
neurodegeneration	PD	D1	Allosteric Modulators of D1 Receptors: Primary Screen	cAMP reporter	target-based	assayID	3	virtual screening, assayID, pathway analysis and repurposing completed	completed	completed	completed	completed	notApplicable	completed	notStarted	notStarted
neurodegeneration	PD	TAAR1	Fluorescence-based cell-based primary high throughput screening assay to identify antagonists of the human trace amine associated receptor 1 (TAAR1)	[Ca++]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	cystic fibrosis	Ano1	Primary cell-based high-throughput screening for identification of compounds that activate/potentiate calcium-activated chloride channels (TMEM16A)	[Cl-]i	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	cystic fibrosis	CFTR	Identification of Small Molecule Correctors of the Cystic Fibrosis Transmembrane Conductance Regulator (CFTR) Delta508 Mutation Function in Human Bronchial Epithelial Cells. Measured in Cell-Based System Using Plate Reader - 7017-01_Other_SinglePoint_HTS_Activity	correction	phenotypic	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway
rare diseases	McCune-Albright syndrome (MAS)	GNAS	qHTS for Antagonists of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS	cAMP	target-based	assayID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	muscularDistrophy	CGA	qHTS for Activators of Integrin-Mediated Alleviation for Muscular Dystrophy	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	Niemann Pick Type C (NPC)	NPC1	qHTS Assay for NPC1 Promoter Activators	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	Niemann Pick Type C (NPC)	RAB9A	qHTS Assay for Rab9 Promoter Activators	expressionReporter	target-based	TID	1	records allow Machine Learning	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted	notStarted
rare diseases	SMA	SMN2	qHTS Assay for Enhancers of SMN2 Splice Variant Expression	expressionReporter	target-based	TID	3	virtual screening, targetID, pathway analysis and repurposing completed	completed	completed	completed	completed	completed	completed	underway	underway