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CompoundPathway IDDescriptionScoreRank

[1] Untitled

Original SMILES:
OC(=O)Cc1c[nH]c2ccccc12

Prepared SMILES:
OC(=O)Cc1c[nH]c2c1cccc2

hsa04610Complement and coagulation cascades0.001373851
hsa04510Focal adhesion0.001087012
hsa03320PPAR signaling pathway0.0009798053
hsa04978Mineral absorption0.0008628684
hsa04915Estrogen signaling pathway0.0008381315
hsa04974Protein digestion and absorption0.0008361366
hsa04151PI3K-Akt signaling pathway0.0008029217
hsa00100Steroid biosynthesis0.0008012748
hsa04640Hematopoietic cell lineage0.0007911649
hsa04612Antigen processing and presentation0.00062924410
hsa04216Ferroptosis0.00059795411
hsa04115p53 signaling pathway0.0005065412
hsa04657IL-17 signaling pathway0.00049313113
hsa04924Renin secretion0.00047787314
hsa04010MAPK signaling pathway0.00044375715
hsa04062Chemokine signaling pathway0.00040966316
hsa04964Proximal tubule bicarbonate reclamation0.00037328717
hsa04066HIF-1 signaling pathway0.00037278418
hsa04670Leukocyte transendothelial migration0.00036776919
hsa04068FoxO signaling pathway0.00036505120
hsa04015Rap1 signaling pathway0.00036202621
hsa04923Regulation of lipolysis in adipocytes0.00035440722
hsa04668TNF signaling pathway0.00035380323
hsa04218Cellular senescence0.00034964624
hsa04961Endocrine and other factor-regulated calcium reabsorption0.00034329625
hsa00010Glycolysis / Gluconeogenesis0.00034175426
hsa04918Thyroid hormone synthesis0.0003332927
hsa04960Aldosterone-regulated sodium reabsorption0.00033163228
hsa04972Pancreatic secretion0.00033089829
hsa00480Glutathione metabolism0.00032978330
hsa00980Metabolism of xenobiotics by cytochrome P4500.00032937231
hsa04979Cholesterol metabolism0.00032774132
hsa04520Adherens junction0.00031685533
hsa00380Tryptophan metabolism0.00030865434
hsa04210Apoptosis0.00029978235
hsa04971Gastric acid secretion0.00029644536
hsa04970Salivary secretion0.00029624837
hsa04926Relaxin signaling pathway0.00028535138
hsa04350TGF-beta signaling pathway0.00028282939
hsa00340Histidine metabolism0.00026977740
hsa04611Platelet activation0.000264941
hsa04310Wnt signaling pathway0.00026263442
hsa04110Cell cycle0.0002607743
hsa04913Ovarian steroidogenesis0.0002542744
hsa04540Gap junction0.00024758145
hsa00051Fructose and mannose metabolism0.00024556246
hsa04928Parathyroid hormone synthesis, secretion and action0.0002383747
hsa00910Nitrogen metabolism0.00023686248
hsa00250Alanine, aspartate and glutamate metabolism0.00022643949
hsa04064NF-kappa B signaling pathway0.00021921650

Job Information

Job IDSubmitted datePrediction typeMethodNetworkMolecular fingerprintOther parameter(s)Score matrix
203792026-01-30
14:39:50
PathwaysDPNetInferDrug-pathway association network for pan-cancer (version 2020)Substructure (also known as FP4) Downloadα = 0.1, β = 0.1, γ = -0.8, k = 2, Top 50Download

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