Job ID(s):

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CompoundPathway IDDescriptionScoreRank

[1] Untitled

Original SMILES:
C[C@@H](O)CC(=O)N[C@@H](Cc1ccccc1)C(=O)O

Prepared SMILES:
C[C@H](CC(=O)N[C@H](C(=O)O)Cc1ccccc1)O

hsa04610Complement and coagulation cascades0.0006091331
hsa04510Focal adhesion0.0005252242
hsa03320PPAR signaling pathway0.000470163
hsa04915Estrogen signaling pathway0.0004477334
hsa00100Steroid biosynthesis0.0004468725
hsa04151PI3K-Akt signaling pathway0.0004416436
hsa04974Protein digestion and absorption0.0004387257
hsa04978Mineral absorption0.0004243398
hsa04640Hematopoietic cell lineage0.000418829
hsa04612Antigen processing and presentation0.00038195410
hsa04216Ferroptosis0.0003498111
hsa04657IL-17 signaling pathway0.00031171112
hsa04115p53 signaling pathway0.00030897813
hsa04924Renin secretion0.00029541514
hsa04010MAPK signaling pathway0.00028445915
hsa04062Chemokine signaling pathway0.0002595616
hsa04066HIF-1 signaling pathway0.00025837617
hsa04015Rap1 signaling pathway0.00025557918
hsa04670Leukocyte transendothelial migration0.0002553519
hsa04964Proximal tubule bicarbonate reclamation0.00025393920
hsa04218Cellular senescence0.00024821
hsa04068FoxO signaling pathway0.00024750722
hsa04961Endocrine and other factor-regulated calcium reabsorption0.00024443723
hsa04668TNF signaling pathway0.0002408524
hsa04923Regulation of lipolysis in adipocytes0.00023828325
hsa04960Aldosterone-regulated sodium reabsorption0.00023675226
hsa04520Adherens junction0.0002363727
hsa04918Thyroid hormone synthesis0.00023470428
hsa00910Nitrogen metabolism0.00023322729
hsa04972Pancreatic secretion0.00022898830
hsa00010Glycolysis / Gluconeogenesis0.00022696731
hsa00380Tryptophan metabolism0.00022534632
hsa00480Glutathione metabolism0.0002235933
hsa00250Alanine, aspartate and glutamate metabolism0.00022201534
hsa04672Intestinal immune network for IgA production0.00022062635
hsa00980Metabolism of xenobiotics by cytochrome P4500.00021881836
hsa04971Gastric acid secretion0.00021627637
hsa04979Cholesterol metabolism0.00021406338
hsa04210Apoptosis0.00021372139
hsa04970Salivary secretion0.00021282140
hsa00340Histidine metabolism0.00021181541
hsa04350TGF-beta signaling pathway0.00021157242
hsa00051Fructose and mannose metabolism0.00020854443
hsa04913Ovarian steroidogenesis0.00020828344
hsa04926Relaxin signaling pathway0.00020369145
hsa04110Cell cycle0.0002018246
hsa04310Wnt signaling pathway0.00019941647
hsa04540Gap junction0.00019606348
hsa00900Terpenoid backbone biosynthesis0.00019326749
hsa00350Tyrosine metabolism0.00018485250

Job Information

Job IDSubmitted datePrediction typeMethodNetworkMolecular fingerprintOther parameter(s)Score matrix
247632026-08-27
18:03:24
PathwaysDPNetInferDrug-pathway association network for pan-cancer (version 2020)MACCS Downloadα = 0.1, β = 0.1, γ = -0.9, k = 2, Top 50Download

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