Results

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Compound	Pathway ID	Description	Score	Rank
[1] Untitled Original SMILES: CC(C)C(CCCN(C)CCC1=CC(=C(C=C1)OC)OC)(C#N)C2=CC(=C(C=C2)OC)OC Prepared SMILES: COc1ccc(cc1OC)CCN(CCCC(c1ccc(c(c1)OC)OC)(C(C)C)C#N)C	hsa00280	Valine, leucine and isoleucine degradation	0.0132672	Known
	hsa00250	Alanine, aspartate and glutamate metabolism	0.0126584	Known
	hsa04510	Focal adhesion	0.00654252	Known
	hsa00100	Steroid biosynthesis	0.00653969	Known
	hsa04151	PI3K-Akt signaling pathway	0.00642749	Known
	hsa04610	Complement and coagulation cascades	0.00628499	Known
	hsa04974	Protein digestion and absorption	0.00606853	Known
	hsa04915	Estrogen signaling pathway	0.00602747	Known
	hsa04066	HIF-1 signaling pathway	0.00586851	Known
	hsa03320	PPAR signaling pathway	0.00585455	1
	hsa04010	MAPK signaling pathway	0.00577659	Known
	hsa04115	p53 signaling pathway	0.0056778	2
	hsa04960	Aldosterone-regulated sodium reabsorption	0.00561568	Known
	hsa04218	Cellular senescence	0.00557942	Known
	hsa04923	Regulation of lipolysis in adipocytes	0.00550281	Known
	hsa04068	FoxO signaling pathway	0.00550164	Known
	hsa04210	Apoptosis	0.00549783	Known
	hsa04216	Ferroptosis	0.0053795	3
	hsa04978	Mineral absorption	0.00516172	4
	hsa04657	IL-17 signaling pathway	0.00498156	5
	hsa04668	TNF signaling pathway	0.00494978	6
	hsa04640	Hematopoietic cell lineage	0.00493851	7
	hsa04015	Rap1 signaling pathway	0.00493217	8
	hsa04110	Cell cycle	0.00488284	9
	hsa04670	Leukocyte transendothelial migration	0.0047619	10
	hsa04924	Renin secretion	0.00468145	11
	hsa00380	Tryptophan metabolism	0.00462575	12
	hsa04612	Antigen processing and presentation	0.00454932	13
	hsa00010	Glycolysis / Gluconeogenesis	0.00453399	14
	hsa04961	Endocrine and other factor-regulated calcium reabsorption	0.00447414	15
	hsa00480	Glutathione metabolism	0.00447114	16
	hsa04964	Proximal tubule bicarbonate reclamation	0.0044457	17
	hsa04520	Adherens junction	0.00440576	18
	hsa04918	Thyroid hormone synthesis	0.0043724	19
	hsa04062	Chemokine signaling pathway	0.00433985	20
	hsa04926	Relaxin signaling pathway	0.00413606	21
	hsa04919	Thyroid hormone signaling pathway	0.00413559	22
	hsa04064	NF-kappa B signaling pathway	0.00413311	23
	hsa00051	Fructose and mannose metabolism	0.00410145	24
	hsa04350	TGF-beta signaling pathway	0.00404739	25
	hsa04970	Salivary secretion	0.00400546	26
	hsa04540	Gap junction	0.00396567	27
	hsa00330	Arginine and proline metabolism	0.00395996	28
	hsa04550	Signaling pathways regulating pluripotency of stem cells	0.00395424	29
	hsa04928	Parathyroid hormone synthesis, secretion and action	0.00392265	30
	hsa04913	Ovarian steroidogenesis	0.00389443	31
	hsa00071	Fatty acid degradation	0.00387768	32
	hsa04972	Pancreatic secretion	0.00372126	33
	hsa00030	Pentose phosphate pathway	0.003691	34
	hsa04625	C-type lectin receptor signaling pathway	0.00364371	35
	hsa04152	AMPK signaling pathway	0.0036393	36
	hsa04012	ErbB signaling pathway	0.00363589	37
	hsa04380	Osteoclast differentiation	0.00361388	38
	hsa04971	Gastric acid secretion	0.00358543	39
	hsa00340	Histidine metabolism	0.00356707	40
	hsa00350	Tyrosine metabolism	0.00353515	41
	hsa04810	Regulation of actin cytoskeleton	0.00351943	42
	hsa04621	NOD-like receptor signaling pathway	0.00347846	43
	hsa04979	Cholesterol metabolism	0.00345679	44
	hsa00900	Terpenoid backbone biosynthesis	0.00340929	45
	hsa00072	Synthesis and degradation of ketone bodies	0.00339663	46
	hsa00910	Nitrogen metabolism	0.00334377	47
	hsa04659	Th17 cell differentiation	0.00325769	48
	hsa04976	Bile secretion	0.00324874	49
hsa04925	Aldosterone synthesis and secretion	0.0031836	50

Job Information

Job ID	Submitted date	Prediction type	Method	Network	Molecular fingerprint	Other parameter(s)	Score matrix
24781	2026-08-28 15:28:07	Pathways	DPNetInfer	Drug-pathway association network for pan-cancer (version 2020)	MACCS Download	α = 0.1, β = 0.1, γ = -0.9, k = 2, Top 50	Download

Results

[1] Untitled

Job Information