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<?xml version='1.0' encoding='utf-8'?>
<graphml xmlns="http://graphml.graphdrawing.org/xmlns" xmlns:xsi="http://www.w3.org/2001/XMLSchema-instance" xsi:schemaLocation="http://graphml.graphdrawing.org/xmlns http://graphml.graphdrawing.org/xmlns/1.0/graphml.xsd"><key id="d4" for="edge" attr.name="potency_nM" attr.type="double"/>
<key id="d3" for="edge" attr.name="relation" attr.type="string"/>
<key id="d2" for="node" attr.name="chembl_id" attr.type="string"/>
<key id="d1" for="node" attr.name="score" attr.type="double"/>
<key id="d0" for="node" attr.name="kind" attr.type="string"/>
<graph edgedefault="undirected"><node id="SNCA">
<data key="d0">target</data>
<data key="d1">77.1</data>
</node>
<node id="alpha-synuclein aggregation and propagation">
<data key="d0">pathway</data>
</node>
<node id="SNCA triplication/A53T iPSC dopaminergic neurons or alpha-synuclein PFF model">
<data key="d0">cell_model</data>
</node>
<node id="pS129 alpha-synuclein, aggregate load, synaptic/neurite phenotypes">
<data key="d0">assay</data>
</node>
<node id="GLP1R">
<data key="d0">target</data>
<data key="d1">77.0</data>
</node>
<node id="metabolic and GLP-1 receptor signalling">
<data key="d0">pathway</data>
</node>
<node id="dopaminergic neuron stress model with metabolic/inflammatory co-culture">
<data key="d0">cell_model</data>
</node>
<node id="neuronal survival, inflammatory cytokines, mitochondrial respiration">
<data key="d0">assay</data>
</node>
<node id="LRRK2">
<data key="d0">target</data>
<data key="d1">76.9</data>
</node>
<node id="LRRK2 kinase and lysosomal stress">
<data key="d0">pathway</data>
</node>
<node id="LRRK2 G2019S or R1441C iPSC-derived dopaminergic neurons">
<data key="d0">cell_model</data>
</node>
<node id="phospho-Rab10/Rab12, lysosomal morphology, neurite survival">
<data key="d0">assay</data>
</node>
<node id="GBA1">
<data key="d0">target</data>
<data key="d1">75.5</data>
</node>
<node id="GBA1 lysosome/autophagy">
<data key="d0">pathway</data>
</node>
<node id="GBA1-mutant iPSC dopaminergic neurons and macrophage/microglia-like cells">
<data key="d0">cell_model</data>
</node>
<node id="glucocerebrosidase activity, lysosomal pH, alpha-synuclein burden">
<data key="d0">assay</data>
</node>
<node id="MAPK1">
<data key="d0">target</data>
<data key="d1">75.4</data>
</node>
<node id="MAP kinase activation">
<data key="d0">pathway</data>
</node>
<node id="stress-response assay in neurons and microglia">
<data key="d0">cell_model</data>
</node>
<node id="phospho-ERK, inflammatory/stress response, toxicity counterscreen">
<data key="d0">assay</data>
</node>
<node id="NOD2">
<data key="d0">target</data>
<data key="d1">74.0</data>
</node>
<node id="NOD1/2 inflammatory signalling">
<data key="d0">pathway</data>
</node>
<node id="iPSC-derived microglia or monocyte-derived macrophages">
<data key="d0">cell_model</data>
</node>
<node id="NOD ligand response, cytokines, inflammasome-related markers">
<data key="d0">assay</data>
</node>
<node id="IL17A">
<data key="d0">target</data>
<data key="d1">73.8</data>
</node>
<node id="IL-17 inflammatory signalling">
<data key="d0">pathway</data>
</node>
<node id="microglia/astrocyte inflammatory co-culture">
<data key="d0">cell_model</data>
</node>
<node id="IL-17 response genes, cytokine release, neuronal stress markers">
<data key="d0">assay</data>
</node>
<node id="TLR2">
<data key="d0">target</data>
<data key="d1">70.9</data>
</node>
<node id="innate immune signalling">
<data key="d0">pathway</data>
</node>
<node id="iPSC-derived microglia and neuron-microglia co-culture">
<data key="d0">cell_model</data>
</node>
<node id="TNF/IL6/IL1B release, NF-kB activation, neuronal toxicity">
<data key="d0">assay</data>
</node>
<node id="NTRK1">
<data key="d0">target</data>
<data key="d1">70.4</data>
</node>
<node id="NTRK/neurotrophin signalling">
<data key="d0">pathway</data>
</node>
<node id="dopaminergic neuron survival/trophic support model">
<data key="d0">cell_model</data>
</node>
<node id="neurite length, survival, phospho-ERK/AKT">
<data key="d0">assay</data>
</node>
<node id="SLC6A3">
<data key="d0">target</data>
<data key="d1">69.1</data>
</node>
<node id="dopaminergic synapse">
<data key="d0">pathway</data>
</node>
<node id="iPSC dopaminergic neuron maturation/readout assay">
<data key="d0">cell_model</data>
</node>
<node id="DAT expression/function, dopamine uptake, neuron identity QC">
<data key="d0">assay</data>
</node>
<node id="PINK1">
<data key="d0">target</data>
<data key="d1">61.2</data>
</node>
<node id="mitochondrial quality control">
<data key="d0">pathway</data>
</node>
<node id="PINK1 knockout iPSC dopaminergic neurons">
<data key="d0">cell_model</data>
</node>
<node id="mitophagy reporter, mitochondrial membrane potential, ATP/ROS">
<data key="d0">assay</data>
</node>
<node id="LAMP2">
<data key="d0">target</data>
<data key="d1">61.0</data>
</node>
<node id="lysosome/autophagy">
<data key="d0">pathway</data>
</node>
<node id="iPSC dopaminergic neurons with lysosomal stress">
<data key="d0">cell_model</data>
</node>
<node id="LC3/p62 flux, lysosomal pH, autophagosome clearance">
<data key="d0">assay</data>
</node>
<node id="MYD88">
<data key="d0">target</data>
<data key="d1">60.4</data>
</node>
<node id="iPSC-derived microglia inflammatory challenge">
<data key="d0">cell_model</data>
</node>
<node id="NF-kB reporter, cytokine release, rescue of co-culture toxicity">
<data key="d0">assay</data>
</node>
<node id="NDUFS3">
<data key="d0">target</data>
<data key="d1">58.6</data>
</node>
<node id="mitochondrial oxidative phosphorylation">
<data key="d0">pathway</data>
</node>
<node id="iPSC dopaminergic neuron mitochondrial stress model">
<data key="d0">cell_model</data>
</node>
<node id="Seahorse OCR, complex I activity, ATP/ROS">
<data key="d0">assay</data>
</node>
<node id="PRKN">
<data key="d0">target</data>
<data key="d1">50.0</data>
</node>
<node id="PRKN knockout iPSC dopaminergic neurons">
<data key="d0">cell_model</data>
</node>
<node id="mitophagy reporter, ubiquitination, mitochondrial stress survival">
<data key="d0">assay</data>
</node>
<node id="CHEMBL353333">
<data key="d0">compound</data>
<data key="d1">78.0</data>
<data key="d2">CHEMBL353333</data>
</node>
<node id="CHEMBL211168">
<data key="d0">compound</data>
<data key="d1">75.0</data>
<data key="d2">CHEMBL211168</data>
</node>
<node id="CHEMBL211095">
<data key="d0">compound</data>
<data key="d1">75.0</data>
<data key="d2">CHEMBL211095</data>
</node>
<node id="GW278681X">
<data key="d0">compound</data>
<data key="d1">73.8</data>
<data key="d2">CHEMBL1794058</data>
</node>
<node id="CHEMBL173427">
<data key="d0">compound</data>
<data key="d1">73.8</data>
<data key="d2">CHEMBL173427</data>
</node>
<node id="CHEMBL175321">
<data key="d0">compound</data>
<data key="d1">73.8</data>
<data key="d2">CHEMBL175321</data>
</node>
<node id="GW301789X">
<data key="d0">compound</data>
<data key="d1">72.8</data>
<data key="d2">CHEMBL1794056</data>
</node>
<node id="CHEMBL27586">
<data key="d0">compound</data>
<data key="d1">72.3</data>
<data key="d2">CHEMBL27586</data>
</node>
<node id="CHEMBL174088">
<data key="d0">compound</data>
<data key="d1">71.7</data>
<data key="d2">CHEMBL174088</data>
</node>
<node id="CHEMBL172179">
<data key="d0">compound</data>
<data key="d1">71.4</data>
<data key="d2">CHEMBL172179</data>
</node>
<node id="CHEMBL28394">
<data key="d0">compound</data>
<data key="d1">71.0</data>
<data key="d2">CHEMBL28394</data>
</node>
<node id="CHEMBL281288">
<data key="d0">compound</data>
<data key="d1">70.4</data>
<data key="d2">CHEMBL281288</data>
</node>
<node id="CHEMBL27336">
<data key="d0">compound</data>
<data key="d1">69.7</data>
<data key="d2">CHEMBL27336</data>
</node>
<node id="CHEMBL3593932">
<data key="d0">compound</data>
<data key="d1">68.4</data>
<data key="d2">CHEMBL3593932</data>
</node>
<node id="GW284408X">
<data key="d0">compound</data>
<data key="d1">68.2</data>
<data key="d2">CHEMBL1794057</data>
</node>
<node id="CHEMBL311347">
<data key="d0">compound</data>
<data key="d1">68.0</data>
<data key="d2">CHEMBL311347</data>
</node>
<node id="CHEMBL398714">
<data key="d0">compound</data>
<data key="d1">68.0</data>
<data key="d2">CHEMBL398714</data>
</node>
<node id="CHEMBL2063787">
<data key="d0">compound</data>
<data key="d1">67.9</data>
<data key="d2">CHEMBL2063787</data>
</node>
<node id="CHEMBL211883">
<data key="d0">compound</data>
<data key="d1">67.8</data>
<data key="d2">CHEMBL211883</data>
</node>
<node id="FLUVOXAMINE">
<data key="d0">compound</data>
<data key="d1">67.7</data>
<data key="d2">CHEMBL814</data>
</node>
<node id="CHEMBL3593904">
<data key="d0">compound</data>
<data key="d1">67.5</data>
<data key="d2">CHEMBL3593904</data>
</node>
<node id="CHEMBL2113063">
<data key="d0">compound</data>
<data key="d1">67.2</data>
<data key="d2">CHEMBL2113063</data>
</node>
<node id="CHEMBL445660">
<data key="d0">compound</data>
<data key="d1">67.0</data>
<data key="d2">CHEMBL445660</data>
</node>
<node id="CHEMBL3593922">
<data key="d0">compound</data>
<data key="d1">66.7</data>
<data key="d2">CHEMBL3593922</data>
</node>
<node id="CHEMBL3593930">
<data key="d0">compound</data>
<data key="d1">66.6</data>
<data key="d2">CHEMBL3593930</data>
</node>
<node id="VILOXAZINE">
<data key="d0">compound</data>
<data key="d1">66.5</data>
<data key="d2">CHEMBL306700</data>
</node>
<node id="CHEMBL3593928">
<data key="d0">compound</data>
<data key="d1">66.4</data>
<data key="d2">CHEMBL3593928</data>
</node>
<node id="CHEMBL173594">
<data key="d0">compound</data>
<data key="d1">66.4</data>
<data key="d2">CHEMBL173594</data>
</node>
<node id="CHEMBL610897">
<data key="d0">compound</data>
<data key="d1">66.2</data>
<data key="d2">CHEMBL610897</data>
</node>
<node id="CHEMBL3593911">
<data key="d0">compound</data>
<data key="d1">66.0</data>
<data key="d2">CHEMBL3593911</data>
</node>
<node id="CHEMBL435341">
<data key="d0">compound</data>
<data key="d1">66.0</data>
<data key="d2">CHEMBL435341</data>
</node>
<node id="CHEMBL2115570">
<data key="d0">compound</data>
<data key="d1">65.4</data>
<data key="d2">CHEMBL2115570</data>
</node>
<node id="DESIPRAMINE">
<data key="d0">compound</data>
<data key="d1">65.0</data>
<data key="d2">CHEMBL72</data>
</node>
<node id="CHEMBL208881">
<data key="d0">compound</data>
<data key="d1">64.8</data>
<data key="d2">CHEMBL208881</data>
</node>
<node id="CHEMBL2113064">
<data key="d0">compound</data>
<data key="d1">64.3</data>
<data key="d2">CHEMBL2113064</data>
</node>
<node id="CHEMBL250091">
<data key="d0">compound</data>
<data key="d1">64.3</data>
<data key="d2">CHEMBL250091</data>
</node>
<node id="CHEMBL249091">
<data key="d0">compound</data>
<data key="d1">63.8</data>
<data key="d2">CHEMBL249091</data>
</node>
<node id="CHEMBL402918">
<data key="d0">compound</data>
<data key="d1">63.7</data>
<data key="d2">CHEMBL402918</data>
</node>
<node id="CHEMBL1976750">
<data key="d0">compound</data>
<data key="d1">63.5</data>
<data key="d2">CHEMBL1976750</data>
</node>
<node id="CHEMBL3593934">
<data key="d0">compound</data>
<data key="d1">63.4</data>
<data key="d2">CHEMBL3593934</data>
</node>
<node id="CHEMBL377243">
<data key="d0">compound</data>
<data key="d1">63.4</data>
<data key="d2">CHEMBL377243</data>
</node>
<node id="CHEMBL212317">
<data key="d0">compound</data>
<data key="d1">63.3</data>
<data key="d2">CHEMBL212317</data>
</node>
<node id="CHEMBL2063785">
<data key="d0">compound</data>
<data key="d1">63.3</data>
<data key="d2">CHEMBL2063785</data>
</node>
<node id="CHEMBL285342">
<data key="d0">compound</data>
<data key="d1">63.2</data>
<data key="d2">CHEMBL285342</data>
</node>
<node id="CHEMBL3593903">
<data key="d0">compound</data>
<data key="d1">63.1</data>
<data key="d2">CHEMBL3593903</data>
</node>
<node id="REBOXETINE">
<data key="d0">compound</data>
<data key="d1">62.8</data>
<data key="d2">CHEMBL14370</data>
</node>
<node id="CHEMBL3593918">
<data key="d0">compound</data>
<data key="d1">62.8</data>
<data key="d2">CHEMBL3593918</data>
</node>
<node id="CHEMBL120490">
<data key="d0">compound</data>
<data key="d1">62.7</data>
<data key="d2">CHEMBL120490</data>
</node>
<node id="CHEMBL4872143">
<data key="d0">compound</data>
<data key="d1">62.6</data>
<data key="d2">CHEMBL4872143</data>
</node>
<node id="CHEMBL399713">
<data key="d0">compound</data>
<data key="d1">62.1</data>
<data key="d2">CHEMBL399713</data>
</node>
<node id="CHEMBL3593926">
<data key="d0">compound</data>
<data key="d1">62.1</data>
<data key="d2">CHEMBL3593926</data>
</node>
<node id="CHEMBL3593905">
<data key="d0">compound</data>
<data key="d1">62.1</data>
<data key="d2">CHEMBL3593905</data>
</node>
<node id="CHEMBL3349996">
<data key="d0">compound</data>
<data key="d1">62.0</data>
<data key="d2">CHEMBL3349996</data>
</node>
<node id="CHEMBL3593902">
<data key="d0">compound</data>
<data key="d1">61.7</data>
<data key="d2">CHEMBL3593902</data>
</node>
<node id="CHEMBL3593908">
<data key="d0">compound</data>
<data key="d1">61.6</data>
<data key="d2">CHEMBL3593908</data>
</node>
<node id="GW442130X">
<data key="d0">compound</data>
<data key="d1">60.8</data>
<data key="d2">CHEMBL176857</data>
</node>
<node id="CHEMBL2113062">
<data key="d0">compound</data>
<data key="d1">60.6</data>
<data key="d2">CHEMBL2113062</data>
</node>
<node id="CHEMBL3593924">
<data key="d0">compound</data>
<data key="d1">59.8</data>
<data key="d2">CHEMBL3593924</data>
</node>
<node id="CHEMBL94678">
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<data key="d1">59.4</data>
<data key="d2">CHEMBL94678</data>
</node>
<node id="CHEMBL3593893">
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<data key="d1">59.2</data>
<data key="d2">CHEMBL3593893</data>
</node>
<node id="CHEMBL3593915">
<data key="d0">compound</data>
<data key="d1">59.2</data>
<data key="d2">CHEMBL3593915</data>
</node>
<node id="CHEMBL2079586">
<data key="d0">compound</data>
<data key="d1">59.1</data>
<data key="d2">CHEMBL2079586</data>
</node>
<node id="CHEMBL3593909">
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<data key="d1">58.1</data>
<data key="d2">CHEMBL3593909</data>
</node>
<node id="NISOXETINE">
<data key="d0">compound</data>
<data key="d1">53.2</data>
<data key="d2">CHEMBL295467</data>
</node>
<node id="COCAINE">
<data key="d0">compound</data>
<data key="d1">53.0</data>
<data key="d2">CHEMBL370805</data>
</node>
<node id="CHEMBL176544">
<data key="d0">compound</data>
<data key="d1">52.6</data>
<data key="d2">CHEMBL176544</data>
</node>
<node id="NINTEDANIB">
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<data key="d1">52.5</data>
<data key="d2">CHEMBL502835</data>
</node>
<node id="CHEMBL3593916">
<data key="d0">compound</data>
<data key="d1">51.9</data>
<data key="d2">CHEMBL3593916</data>
</node>
<node id="CHEMBL377040">
<data key="d0">compound</data>
<data key="d1">51.8</data>
<data key="d2">CHEMBL377040</data>
</node>
<node id="CHEMBL3593913">
<data key="d0">compound</data>
<data key="d1">51.8</data>
<data key="d2">CHEMBL3593913</data>
</node>
<node id="CHEMBL377444">
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<data key="d2">CHEMBL377444</data>
</node>
<node id="CHEMBL2063797">
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<data key="d1">51.5</data>
<data key="d2">CHEMBL2063797</data>
</node>
<node id="CHEMBL3593901">
<data key="d0">compound</data>
<data key="d1">51.5</data>
<data key="d2">CHEMBL3593901</data>
</node>
<node id="CHEMBL3593923">
<data key="d0">compound</data>
<data key="d1">51.4</data>
<data key="d2">CHEMBL3593923</data>
</node>
<node id="CHEMBL3593931">
<data key="d0">compound</data>
<data key="d1">51.2</data>
<data key="d2">CHEMBL3593931</data>
</node>
<node id="CHEMBL3593910">
<data key="d0">compound</data>
<data key="d1">51.1</data>
<data key="d2">CHEMBL3593910</data>
</node>
<node id="CHEMBL2063798">
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<data key="d1">50.9</data>
<data key="d2">CHEMBL2063798</data>
</node>
<node id="CHEMBL250747">
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<data key="d2">CHEMBL250747</data>
</node>
<node id="CHEMBL369490">
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<data key="d2">CHEMBL369490</data>
</node>
<node id="GW275616X">
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<data key="d1">50.6</data>
<data key="d2">CHEMBL1794059</data>
</node>
<edge source="SNCA" target="alpha-synuclein aggregation and propagation">
<data key="d3">belongs_to_pathway</data>
</edge>
<edge source="SNCA" target="SNCA triplication/A53T iPSC dopaminergic neurons or alpha-synuclein PFF model">
<data key="d3">validated_in_model</data>
</edge>
<edge source="SNCA" target="CHEMBL3593932">
<data key="d3">has_refined_activity</data>
<data key="d4">2.1</data>
</edge>
<edge source="SNCA" target="CHEMBL2063787">
<data key="d3">has_refined_activity</data>
<data key="d4">32.1</data>
</edge>
<edge source="SNCA" target="CHEMBL3593904">
<data key="d3">has_refined_activity</data>
<data key="d4">11.5</data>
</edge>
<edge source="SNCA" target="CHEMBL3593922">
<data key="d3">has_refined_activity</data>
<data key="d4">14.6</data>
</edge>
<edge source="SNCA" target="CHEMBL3593930">
<data key="d3">has_refined_activity</data>
<data key="d4">3.5</data>
</edge>
<edge source="SNCA" target="CHEMBL3593928">
<data key="d3">has_refined_activity</data>
<data key="d4">3.8</data>
</edge>
<edge source="SNCA" target="CHEMBL3593911">
<data key="d3">has_refined_activity</data>
<data key="d4">4.2</data>
</edge>
<edge source="SNCA" target="CHEMBL1976750">
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<data key="d3">has_refined_activity</data>
<data key="d4">8.9</data>
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<data key="d3">has_refined_activity</data>
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<data key="d3">has_refined_activity</data>
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<data key="d4">49.0</data>
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<data key="d3">has_refined_activity</data>
<data key="d4">206.7</data>
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<data key="d3">has_refined_activity</data>
<data key="d4">211.4</data>
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<data key="d4">53.3</data>
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<data key="d4">54.6</data>
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<data key="d4">107.0</data>
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<data key="d4">175.0</data>
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<data key="d4">253.0</data>
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<data key="d3">has_refined_activity</data>
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<data key="d3">belongs_to_pathway</data>
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<data key="d4">47.0</data>
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