Datasets:

hssling
/

pd-discovery-benchmark-dashboard

node,kind,score,chembl_id

SNCA,target,77.1,
alpha-synuclein aggregation and propagation,pathway,,
SNCA triplication/A53T iPSC dopaminergic neurons or alpha-synuclein PFF model,cell_model,,
"pS129 alpha-synuclein, aggregate load, synaptic/neurite phenotypes",assay,,

GLP1R,target,77.0,
metabolic and GLP-1 receptor signalling,pathway,,
dopaminergic neuron stress model with metabolic/inflammatory co-culture,cell_model,,
"neuronal survival, inflammatory cytokines, mitochondrial respiration",assay,,

LRRK2,target,76.9,
LRRK2 kinase and lysosomal stress,pathway,,
LRRK2 G2019S or R1441C iPSC-derived dopaminergic neurons,cell_model,,
"phospho-Rab10/Rab12, lysosomal morphology, neurite survival",assay,,

GBA1,target,75.5,
GBA1 lysosome/autophagy,pathway,,
GBA1-mutant iPSC dopaminergic neurons and macrophage/microglia-like cells,cell_model,,
"glucocerebrosidase activity, lysosomal pH, alpha-synuclein burden",assay,,

MAPK1,target,75.4,
MAP kinase activation,pathway,,
stress-response assay in neurons and microglia,cell_model,,
"phospho-ERK, inflammatory/stress response, toxicity counterscreen",assay,,

NOD2,target,74.0,
NOD1/2 inflammatory signalling,pathway,,
iPSC-derived microglia or monocyte-derived macrophages,cell_model,,
"NOD ligand response, cytokines, inflammasome-related markers",assay,,

IL17A,target,73.8,
IL-17 inflammatory signalling,pathway,,
microglia/astrocyte inflammatory co-culture,cell_model,,
"IL-17 response genes, cytokine release, neuronal stress markers",assay,,

TLR2,target,70.9,
innate immune signalling,pathway,,
iPSC-derived microglia and neuron-microglia co-culture,cell_model,,
"TNF/IL6/IL1B release, NF-kB activation, neuronal toxicity",assay,,

NTRK1,target,70.4,
NTRK/neurotrophin signalling,pathway,,
dopaminergic neuron survival/trophic support model,cell_model,,
"neurite length, survival, phospho-ERK/AKT",assay,,

SLC6A3,target,69.1,
dopaminergic synapse,pathway,,
iPSC dopaminergic neuron maturation/readout assay,cell_model,,
"DAT expression/function, dopamine uptake, neuron identity QC",assay,,

PINK1,target,61.2,
mitochondrial quality control,pathway,,
PINK1 knockout iPSC dopaminergic neurons,cell_model,,
"mitophagy reporter, mitochondrial membrane potential, ATP/ROS",assay,,

LAMP2,target,61.0,
lysosome/autophagy,pathway,,
iPSC dopaminergic neurons with lysosomal stress,cell_model,,
"LC3/p62 flux, lysosomal pH, autophagosome clearance",assay,,

MYD88,target,60.4,
iPSC-derived microglia inflammatory challenge,cell_model,,
"NF-kB reporter, cytokine release, rescue of co-culture toxicity",assay,,

NDUFS3,target,58.6,
mitochondrial oxidative phosphorylation,pathway,,
iPSC dopaminergic neuron mitochondrial stress model,cell_model,,
"Seahorse OCR, complex I activity, ATP/ROS",assay,,

PRKN,target,50.0,
PRKN knockout iPSC dopaminergic neurons,cell_model,,
"mitophagy reporter, ubiquitination, mitochondrial stress survival",assay,,

CHEMBL353333,compound,78.0,CHEMBL353333

CHEMBL211168,compound,75.0,CHEMBL211168

CHEMBL211095,compound,75.0,CHEMBL211095

GW278681X,compound,73.8,CHEMBL1794058

CHEMBL173427,compound,73.8,CHEMBL173427

CHEMBL175321,compound,73.8,CHEMBL175321

GW301789X,compound,72.8,CHEMBL1794056

CHEMBL27586,compound,72.3,CHEMBL27586

CHEMBL174088,compound,71.7,CHEMBL174088

CHEMBL172179,compound,71.4,CHEMBL172179

CHEMBL28394,compound,71.0,CHEMBL28394

CHEMBL281288,compound,70.4,CHEMBL281288

CHEMBL27336,compound,69.7,CHEMBL27336

CHEMBL3593932,compound,68.4,CHEMBL3593932

GW284408X,compound,68.2,CHEMBL1794057

CHEMBL311347,compound,68.0,CHEMBL311347

CHEMBL398714,compound,68.0,CHEMBL398714

CHEMBL2063787,compound,67.9,CHEMBL2063787

CHEMBL211883,compound,67.8,CHEMBL211883

FLUVOXAMINE,compound,67.7,CHEMBL814

CHEMBL3593904,compound,67.5,CHEMBL3593904

CHEMBL2113063,compound,67.2,CHEMBL2113063

CHEMBL445660,compound,67.0,CHEMBL445660

CHEMBL3593922,compound,66.7,CHEMBL3593922

CHEMBL3593930,compound,66.6,CHEMBL3593930

VILOXAZINE,compound,66.5,CHEMBL306700

CHEMBL3593928,compound,66.4,CHEMBL3593928

CHEMBL173594,compound,66.4,CHEMBL173594

CHEMBL610897,compound,66.2,CHEMBL610897

CHEMBL3593911,compound,66.0,CHEMBL3593911

CHEMBL435341,compound,66.0,CHEMBL435341

CHEMBL2115570,compound,65.4,CHEMBL2115570

DESIPRAMINE,compound,65.0,CHEMBL72

CHEMBL208881,compound,64.8,CHEMBL208881

CHEMBL2113064,compound,64.3,CHEMBL2113064

CHEMBL250091,compound,64.3,CHEMBL250091

CHEMBL249091,compound,63.8,CHEMBL249091

CHEMBL402918,compound,63.7,CHEMBL402918

CHEMBL1976750,compound,63.5,CHEMBL1976750

CHEMBL3593934,compound,63.4,CHEMBL3593934

CHEMBL377243,compound,63.4,CHEMBL377243

CHEMBL212317,compound,63.3,CHEMBL212317

CHEMBL2063785,compound,63.3,CHEMBL2063785

CHEMBL285342,compound,63.2,CHEMBL285342

CHEMBL3593903,compound,63.1,CHEMBL3593903

REBOXETINE,compound,62.8,CHEMBL14370

CHEMBL3593918,compound,62.8,CHEMBL3593918

CHEMBL120490,compound,62.7,CHEMBL120490

CHEMBL4872143,compound,62.6,CHEMBL4872143

CHEMBL399713,compound,62.1,CHEMBL399713

CHEMBL3593926,compound,62.1,CHEMBL3593926

CHEMBL3593905,compound,62.1,CHEMBL3593905

CHEMBL3349996,compound,62.0,CHEMBL3349996

CHEMBL3593902,compound,61.7,CHEMBL3593902

CHEMBL3593908,compound,61.6,CHEMBL3593908

GW442130X,compound,60.8,CHEMBL176857

CHEMBL2113062,compound,60.6,CHEMBL2113062

CHEMBL3593924,compound,59.8,CHEMBL3593924

CHEMBL94678,compound,59.4,CHEMBL94678

CHEMBL3593893,compound,59.2,CHEMBL3593893

CHEMBL3593915,compound,59.2,CHEMBL3593915

CHEMBL2079586,compound,59.1,CHEMBL2079586

CHEMBL3593909,compound,58.1,CHEMBL3593909

NISOXETINE,compound,53.2,CHEMBL295467

COCAINE,compound,53.0,CHEMBL370805

CHEMBL176544,compound,52.6,CHEMBL176544

NINTEDANIB,compound,52.5,CHEMBL502835

CHEMBL3593916,compound,51.9,CHEMBL3593916

CHEMBL377040,compound,51.8,CHEMBL377040

CHEMBL3593913,compound,51.8,CHEMBL3593913

CHEMBL377444,compound,51.6,CHEMBL377444

CHEMBL2063797,compound,51.5,CHEMBL2063797

CHEMBL3593901,compound,51.5,CHEMBL3593901

CHEMBL3593923,compound,51.4,CHEMBL3593923

CHEMBL3593931,compound,51.2,CHEMBL3593931

CHEMBL3593910,compound,51.1,CHEMBL3593910

CHEMBL2063798,compound,50.9,CHEMBL2063798

CHEMBL250747,compound,50.8,CHEMBL250747

CHEMBL369490,compound,50.7,CHEMBL369490

GW275616X,compound,50.6,CHEMBL1794059