Job ID(s):

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CompoundPathway IDDescriptionScoreRank

[1] Untitled

Original SMILES:
COc1c(C=CC(c2ccc(OC(C)C)c(C/C=C(C)\C)c2)=O)ccc(OC(C)C)c1OC(C)C

Prepared SMILES:
COc1c(C=CC(=O)c2ccc(c(c2)CC=C(C)C)OC(C)C)ccc(c1OC(C)C)OC(C)C

hsa04610Complement and coagulation cascades0.0006428681
hsa04510Focal adhesion0.0005401392
hsa03320PPAR signaling pathway0.0004886253
hsa00100Steroid biosynthesis0.0004694214
hsa04915Estrogen signaling pathway0.0004646275
hsa04151PI3K-Akt signaling pathway0.0004598336
hsa04974Protein digestion and absorption0.000451317
hsa04978Mineral absorption0.0004418238
hsa04640Hematopoietic cell lineage0.0004251459
hsa04612Antigen processing and presentation0.00037313510
hsa04216Ferroptosis0.00037138911
hsa04657IL-17 signaling pathway0.00032411112
hsa04115p53 signaling pathway0.00031562813
hsa04924Renin secretion0.00030824814
hsa04010MAPK signaling pathway0.00029691115
hsa04066HIF-1 signaling pathway0.00027178416
hsa04015Rap1 signaling pathway0.00026891817
hsa04062Chemokine signaling pathway0.0002661918
hsa04670Leukocyte transendothelial migration0.0002641219
hsa04218Cellular senescence0.0002623420
hsa04964Proximal tubule bicarbonate reclamation0.0002566621
hsa04068FoxO signaling pathway0.00025625822
hsa04961Endocrine and other factor-regulated calcium reabsorption0.00025276623
hsa04520Adherens junction0.00025152924
hsa04923Regulation of lipolysis in adipocytes0.00024697225
hsa04960Aldosterone-regulated sodium reabsorption0.0002468726
hsa04668TNF signaling pathway0.00024494727
hsa04918Thyroid hormone synthesis0.00024477328
hsa00250Alanine, aspartate and glutamate metabolism0.00024276329
hsa04972Pancreatic secretion0.0002404430
hsa00980Metabolism of xenobiotics by cytochrome P4500.00023896731
hsa00010Glycolysis / Gluconeogenesis0.00023595332
hsa04310Wnt signaling pathway0.00023183233
hsa04913Ovarian steroidogenesis0.0002311334
hsa00380Tryptophan metabolism0.00023042735
hsa00480Glutathione metabolism0.00023035136
hsa04970Salivary secretion0.00022553937
hsa00910Nitrogen metabolism0.00022391838
hsa00051Fructose and mannose metabolism0.00022361439
hsa04926Relaxin signaling pathway0.00022285640
hsa04210Apoptosis0.00021925641
hsa04971Gastric acid secretion0.00021450942
hsa04350TGF-beta signaling pathway0.00021407643
hsa00340Histidine metabolism0.00021209144
hsa04540Gap junction0.00021012345
hsa04110Cell cycle0.00020459246
hsa00900Terpenoid backbone biosynthesis0.00019929847
hsa04979Cholesterol metabolism0.00019833648
hsa04614Renin-angiotensin system0.0001957649
hsa00350Tyrosine metabolism0.00019320950

Job Information

Job IDSubmitted datePrediction typeMethodNetworkMolecular fingerprintOther parameter(s)Score matrix
186542025-10-22
12:31:19
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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