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CompoundTarget IDProtein nameProtein familyGene symbolGene IDOrganismScoreRank

[1] Untitled

Original SMILES:
CC(C)(C1=CC=C(C=C1)OCC2CO2)C3=CC=C(C=C3)OCC4CO4

Prepared SMILES:
CC(c1ccc(cc1)OCC1OC1)(c1ccc(cc1)OCC1OC1)C

P10636Microtubule-associated protein tau (Neurofibrillary tangle protein) (Paired helical filament-tau) (PHF-tau)MAPT4137;Homo sapiens (Human)0.0413454Known
P46063ATP-dependent DNA helicase Q1 (EC 3.6.4.12) (DNA helicase, RecQ-like type ...Helicase family, RecQ subfamilyRECQL5965;Homo sapiens (Human)0.008056881
Q9UBT6DNA polymerase kappa (EC 2.7.7.7) (DINB protein) (DINP)DNA polymerase type-Y familyPOLK51426;Homo sapiens (Human)0.00673982
P27695DNA-(apurinic or apyrimidinic site) lyase (EC 3.1.-.-) (EC 4.2.99.18) (APEX ...DNA repair enzymes AP/ExoA familyAPEX1328;Homo sapiens (Human)0.006572923
P1542815-hydroxyprostaglandin dehydrogenase [NAD(+)] (15-PGDH) (EC 1.1.1.141) (Prostaglandin dehydrogenase 1) (Short ...Short-chain dehydrogenases/reductases (SDR) familyHPGD3248;Homo sapiens (Human)0.006459834
O15296Arachidonate 15-lipoxygenase B (15-LOX-B) (EC 1.13.11.33) (15-lipoxygenase 2) (15-LOX-2) (Arachidonate ...Lipoxygenase familyALOX15B247;Homo sapiens (Human)0.006377035
B2RXH2Lysine-specific demethylase 4E (EC 1.14.11.-) (KDM4D-like protein) (Lysine-specific demethylase 4D-like)JHDM3 histone demethylase familyKDM4E390245;Homo sapiens (Human)0.006257026
P11473Vitamin D3 receptor (VDR) (1,25-dihydroxyvitamin D3 receptor) (Nuclear receptor subfamily ...Nuclear hormone receptor family, NR1 subfamilyVDR7421;Homo sapiens (Human)0.006110037
Q997143-hydroxyacyl-CoA dehydrogenase type-2 (EC 1.1.1.35) (17-beta-hydroxysteroid dehydrogenase 10) (17-beta-HSD 10) ...Short-chain dehydrogenases/reductases (SDR) familyHSD17B103028;Homo sapiens (Human)0.005975188
O14746Telomerase reverse transcriptase (EC 2.7.7.49) (HEST2) (Telomerase catalytic subunit) (Telomerase-associated ...Reverse transcriptase family, Telomerase subfamilyTERT7015;Homo sapiens (Human)0.005524519
O94782Ubiquitin carboxyl-terminal hydrolase 1 (EC 3.4.19.12) (Deubiquitinating enzyme 1) (hUBP) ...Peptidase C19 familyUSP17398;Homo sapiens (Human)0.0054731610
P21980Protein-glutamine gamma-glutamyltransferase 2 (EC 2.3.2.13) (Tissue transglutaminase) (Transglutaminase C) (TG(C)) ...Transglutaminase superfamily, Transglutaminase familyTGM27052;Homo sapiens (Human)0.0046287211
P05067Amyloid-beta precursor protein (APP) (ABPP) (APPI) (Alzheimer disease amyloid protein) ...APP familyAPP351;Homo sapiens (Human)0.0044157612
Q11130Alpha-(1,3)-fucosyltransferase 7 (EC 2.4.1.-) (Fucosyltransferase 7) (Fucosyltransferase VII) (Fuc-TVII) (FucT-VII) ...Glycosyltransferase 10 familyFUT72529;Homo sapiens (Human)0.0043051413
P08575Receptor-type tyrosine-protein phosphatase C (EC 3.1.3.48) (Leukocyte common antigen) (L-CA) ...Protein-tyrosine phosphatase family, Receptor class 1/6 subfamilyPTPRC5788;Homo sapiens (Human)0.004286814
P54132Bloom syndrome protein (EC 3.6.4.12) (DNA helicase, RecQ-like type 2) ...Helicase family, RecQ subfamilyBLM641;Homo sapiens (Human)0.0042744215
P05121Plasminogen activator inhibitor 1 (PAI) (PAI-1) (Endothelial plasminogen activator inhibitor) ...Serpin familySERPINE15054;Homo sapiens (Human)0.0041881716
Q9NUW8Tyrosyl-DNA phosphodiesterase 1 (Tyr-DNA phosphodiesterase 1) (EC 3.1.4.-)Tyrosyl-DNA phosphodiesterase familyTDP155775;Homo sapiens (Human)0.0041130717
P11308Transcriptional regulator ERG (Transforming protein ERG)ETS familyERG2078;Homo sapiens (Human)0.0041019518
P51531Probable global transcription activator SNF2L2 (EC 3.6.4.-) (ATP-dependent helicase SMARCA2) ...SNF2/RAD54 helicase familySMARCA26595;Homo sapiens (Human)0.0039832819
P16050Arachidonate 15-lipoxygenase (15-LOX) (15-LOX-1) (EC 1.13.11.33) (12/15-lipoxygenase) (Arachidonate 12-lipoxygenase, leukocyte-type) ...Lipoxygenase familyALOX15246;Homo sapiens (Human)0.0038042920
Q09472Histone acetyltransferase p300 (p300 HAT) (EC 2.3.1.48) (E1A-associated protein p300) ...EP3002033;Homo sapiens (Human)0.0037873821
Q9HC16DNA dC->dU-editing enzyme APOBEC-3G (EC 3.5.4.-) (APOBEC-related cytidine deaminase) (APOBEC-related ...Cytidine and deoxycytidylate deaminase familyAPOBEC3G60489;Homo sapiens (Human)0.0037866622
O75874Isocitrate dehydrogenase [NADP] cytoplasmic (IDH) (EC 1.1.1.42) (Cytosolic NADP-isocitrate dehydrogenase) ...Isocitrate and isopropylmalate dehydrogenases familyIDH13417;Homo sapiens (Human)0.0037483623
O15121Sphingolipid delta(4)-desaturase DES1 (EC 1.14.19.17) (Cell migration-inducing gene 15 protein) ...Fatty acid desaturase type 1 family, DEGS subfamilyDEGS18560;Homo sapiens (Human)0.0036697824
Q96QE3ATPase family AAA domain-containing protein 5 (Chromosome fragility-associated gene 1 ...AAA ATPase familyATAD579915;Homo sapiens (Human)0.0036463725
P06746DNA polymerase beta (EC 2.7.7.7) (EC 4.2.99.-)DNA polymerase type-X familyPOLB5423;Homo sapiens (Human)0.0036174926
P24855Deoxyribonuclease-1 (EC 3.1.21.1) (Deoxyribonuclease I) (DNase I) (Dornase alfa)DNase I familyDNASE11773;Homo sapiens (Human)0.0035563227
Q9Y2R2Tyrosine-protein phosphatase non-receptor type 22 (EC 3.1.3.48) (Hematopoietic cell protein-tyrosine ...Protein-tyrosine phosphatase family, Non-receptor class 4 subfamilyPTPN2226191;Homo sapiens (Human)0.0035469928
P04637Cellular tumor antigen p53 (Antigen NY-CO-13) (Phosphoprotein p53) (Tumor suppressor ...P53 familyTP537157;Homo sapiens (Human)0.0033937129
Q96KQ7Histone-lysine N-methyltransferase EHMT2 (EC 2.1.1.-) (EC 2.1.1.43) (Euchromatic histone-lysine N-methyltransferase ...Class V-like SAM-binding methyltransferase superfamily, Histone-lysine methyltransferase family, Suvar3-9 subfamilyEHMT210919;Homo sapiens (Human)0.0032734230
Q14191Werner syndrome ATP-dependent helicase (EC 3.6.4.12) (DNA helicase, RecQ-like type ...Helicase family, RecQ subfamilyWRN7486;Homo sapiens (Human)0.0032339831
P47871Glucagon receptor (GL-R)G-protein coupled receptor 2 familyGCGR2642;Homo sapiens (Human)0.0032193832
P04062Lysosomal acid glucosylceramidase (Lysosomal acid GCase) (EC 3.2.1.45) (Acid beta-glucosidase) ...Glycosyl hydrolase 30 familyGBA2629;Homo sapiens (Human)0.0032154233
P62508Estrogen-related receptor gamma (ERR gamma-2) (Estrogen receptor-related protein 3) (Nuclear ...Nuclear hormone receptor family, NR3 subfamilyESRRG2104;Homo sapiens (Human)0.0031710834
P05177Cytochrome P450 1A2 (EC 1.14.14.1) (CYPIA2) (Cholesterol 25-hydroxylase) (Cytochrome P(3)450) ...Cytochrome P450 familyCYP1A21544;Homo sapiens (Human)0.0031491635
O75604Ubiquitin carboxyl-terminal hydrolase 2 (EC 3.4.19.12) (41 kDa ubiquitin-specific protease) ...Peptidase C19 family, USP2 subfamilyUSP29099;Homo sapiens (Human)0.0031216136
P10619Lysosomal protective protein (EC 3.4.16.5) (Carboxypeptidase C) (Carboxypeptidase L) (Cathepsin ...Peptidase S10 familyCTSA5476;Homo sapiens (Human)0.0031164237
P37840Alpha-synuclein (Non-A beta component of AD amyloid) (Non-A4 component of ...Synuclein familySNCA6622;Homo sapiens (Human)0.002983438
P30305M-phase inducer phosphatase 2 (EC 3.1.3.48) (Dual specificity phosphatase Cdc25B)MPI phosphatase familyCDC25B994;Homo sapiens (Human)0.0029790239
P08684Cytochrome P450 3A4 (EC 1.14.14.-) (1,8-cineole 2-exo-monooxygenase) (EC 1.14.14.56) (Albendazole ...Cytochrome P450 familyCYP3A41576;Homo sapiens (Human)0.0029649240
P39748Flap endonuclease 1 (FEN-1) (EC 3.1.-.-) (DNase IV) (Flap structure-specific ...XPG/RAD2 endonuclease family, FEN1 subfamilyFEN12237;Homo sapiens (Human)0.0029347141
P00352Retinal dehydrogenase 1 (RALDH 1) (RalDH1) (EC 1.2.1.-) (EC 1.2.1.36) ...Aldehyde dehydrogenase familyALDH1A1216;Homo sapiens (Human)0.0029318342
Q92830Histone acetyltransferase KAT2A (EC 2.3.1.48) (General control of amino acid ...Acetyltransferase family, GCN5 subfamilyKAT2A2648;Homo sapiens (Human)0.0029276643
Q8IUX4DNA dC->dU-editing enzyme APOBEC-3F (EC 3.5.4.38) (Apolipoprotein B mRNA-editing enzyme ...Cytidine and deoxycytidylate deaminase familyAPOBEC3F200316;Homo sapiens (Human)0.0029231144
Q9NR56Muscleblind-like protein 1 (Triplet-expansion RNA-binding protein)Muscleblind familyMBNL14154;Homo sapiens (Human)0.0028959645
O75164Lysine-specific demethylase 4A (EC 1.14.11.-) (JmjC domain-containing histone demethylation protein ...JHDM3 histone demethylase familyKDM4A9682;Homo sapiens (Human)0.002851346
P53350Serine/threonine-protein kinase PLK1 (EC 2.7.11.21) (Polo-like kinase 1) (PLK-1) (Serine/threonine-protein ...Protein kinase superfamily, Ser/Thr protein kinase family, CDC5/Polo subfamilyPLK15347;Homo sapiens (Human)0.0028170147
P84022Mothers against decapentaplegic homolog 3 (MAD homolog 3) (Mad3) (Mothers ...Dwarfin/SMAD familySMAD34088;Homo sapiens (Human)0.0028055648
P00748Coagulation factor XII (EC 3.4.21.38) (Hageman factor) (HAF) [Cleaved into: ...Peptidase S1 familyF122161;Homo sapiens (Human)0.0027774649
P21397Amine oxidase [flavin-containing] A (EC 1.4.3.4) (Monoamine oxidase type A) ...Flavin monoamine oxidase familyMAOA4128;Homo sapiens (Human)0.0027636150

Job Information

Job IDSubmitted datePrediction typeMethodNetworkMolecular fingerprintOther parameter(s)Score matrix
190182025-11-12
16:49:24		Target proteinsBalanced Substructure-Drug-Target Network-Based Inference (bSDTNBI)Global drug-target interaction (DTI) network (version 2020)MACCS Downloadα = 0.4, β = 0.9, γ = -0.7, k = 2, Top 50Download

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