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Network of interactions between drugs (red spheres) and targets (blue spheres) is displayed above.
The red lines are used for the predicted interactions and the thickness of edges indicate the confidence score of predictions.

Data source: DrugBank-all; Query type: chemical; # of requested predictions: 20; Secondary interactions: no
Input drug 1: DB05015
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB05015 Belinostat Thumb


11 known interactions (targets) of input drug (DB05015): Belinostat
No. Gene UniProt ID Protein Name Pathway PDB
1 HDAC1 Q13547 Histone deacetylase 1 hsa04110; hsa04213; hsa04330; hsa04919; hsa05016; hsa05031; hsa05034; hsa05165; hsa05169; hsa05200; hsa05202; hsa05203; hsa05206; hsa05220 1TYI; 4BKX
2 HDAC2 Q92769 Histone deacetylase 2 hsa04110; hsa04213; hsa04330; hsa04919; hsa05016; hsa05034; hsa05165; hsa05169; hsa05200; hsa05202; hsa05203; hsa05220 3MAX; 4LXZ; 4LY1
3 HDAC7 Q8WUI4 Histone deacetylase 7 hsa05034; hsa05165; hsa05203 3C0Y; 3C0Z; 3C10; 3ZNR; 3ZNS
4 HDAC3 O15379 Histone deacetylase 3 hsa04919; hsa05034; hsa05165; hsa05203 4A69
5 HDAC4 P56524 Histone deacetylase 4 hsa04371; hsa05034; hsa05165; hsa05169; hsa05203; hsa05206 2H8N; 2O94; 2VQJ; 2VQM; 2VQO; 2VQQ; 2VQV; 2VQW; 3UXG; 3UZD; 3V31; 4CBT; 4CBY
6 HDAC11 Q96DB2 Histone deacetylase 11 hsa05034; hsa05165; hsa05203 NA
7 HDAC10 Q969S8 Histone deacetylase 10 hsa05034; hsa05165; hsa05203 NA
8 HDAC9 Q9UKV0 Histone deacetylase 9 hsa05034; hsa05165; hsa05203 5EEN;
9 HDAC8 Q9BY41 Histone deacetylase 8 hsa05034; hsa05165; hsa05203
10 HDAC6 Q9UBN7 Histone deacetylase 6 hsa05034; hsa05165; hsa05203 3C5K; 3GV4; 3PHD
11 HDAC5 Q9UQL6 Histone deacetylase 5 hsa04371; hsa05034; hsa05165; hsa05169; hsa05203 NA


20 predicted interactions (targets) of input drug (DB05015): Belinostat
No. Gene UniProt ID Protein Name Pathway PDB Confidence score
1 TP53 P04637 Cellular tumor antigen p53 hsa01522; hsa01524; hsa04010; hsa04071; hsa04110; hsa04115; hsa04137; hsa04151; hsa04210; hsa04211; hsa04216; hsa04218; hsa04310; hsa04722; hsa04919; hsa05014; hsa05016; hsa05160; hsa05161; hsa05162; hsa05163; hsa05165; hsa05166; hsa05167; hsa05168; hsa05169; hsa05200; hsa05202; hsa05203; hsa05205; hsa05206; hsa05210; hsa05212; hsa05213; hsa05214; hsa05215; hsa05216; hsa05217; hsa05218; hsa05219; hsa05220; hsa05222; hsa05223; hsa05224; hsa05225; hsa05226; hsa05230; hsa05418 28.6%
2 PNP P00491 Purine nucleoside phosphorylase hsa00230; hsa00240; hsa00760; hsa01100 25.4%
3 NOS2 P35228 Nitric oxide synthase, inducible hsa00220; hsa00330; hsa01100; hsa04020; hsa04066; hsa04146; hsa04371; hsa04926; hsa05132; hsa05133; hsa05140; hsa05142; hsa05145; hsa05146; hsa05152; hsa05200; hsa05222 1NSI; 2LL6; 2NSI; 3E7G; 3EJ8; 3HR4; 4CX7; 4NOS 24.4%
4 ADRB1 P08588 Beta-1 adrenergic receptor hsa04020; hsa04022; hsa04024; hsa04080; hsa04261; hsa04540; hsa04923; hsa04924; hsa04970; hsa05414 2LSQ 23.5%
5 ADRB3 P13945 Beta-3 adrenergic receptor hsa04020; hsa04022; hsa04080; hsa04714; hsa04923; hsa04924; hsa04970 2CDW 22.8%
6 TACR1 P25103 Substance-P receptor hsa04020; hsa04080; hsa05162 2KS9; 2KSA; 2KSB 21.6%
7 HTR1D P28221 5-hydroxytryptamine receptor 1D hsa04024; hsa04080; hsa04726; hsa04742 NA 21.6%
8 HRH1 P35367 Histamine H1 receptor hsa04020; hsa04080; hsa04750 3RZE 20.1%
9 SCN1A P35498 Sodium channel protein type 1 subunit alpha hsa04728 NA 19.9%
10 SIRT5 Q9NXA8 NAD-dependent protein deacylase sirtuin-5, mitochondrial NA 2B4Y; 2NYR; 3RIG; 3RIY; 4F4U; 4F56; 4G1C; 4HDA 19.6%
11 PLK1 P53350 Serine/threonine-protein kinase PLK1 hsa04068; hsa04110; hsa04114; hsa04914 18.7%
12 HRH2 P25021 Histamine H2 receptor hsa04020; hsa04080; hsa04971 NA 18.5%
13 NOS1 P29475 Nitric oxide synthase, brain hsa00220; hsa00330; hsa01100; hsa04020; hsa04145; hsa04371; hsa04713; hsa04730; hsa04926; hsa04970; hsa05010; hsa05014 4D1N; 4UCH; 4UH5; 4UH6; 4V3U; 5ADF; 5ADG; 5ADI 18.4%
14 TNF P01375 Tumor necrosis factor hsa01523; hsa04010; hsa04060; hsa04064; hsa04071; hsa04150; hsa04210; hsa04217; hsa04350; hsa04380; hsa04612; hsa04620; hsa04621; hsa04622; hsa04625; hsa04640; hsa04650; hsa04657; hsa04660; hsa04664; hsa04668; hsa04920; hsa04930; hsa04931; hsa04932; hsa04933; hsa04940; hsa05010; hsa05014; hsa05133; hsa05134; hsa05140; hsa05142; hsa05143; hsa05144; hsa05145; hsa05146; hsa05152; hsa05160; hsa05161; hsa05163; hsa05164; hsa05165; hsa05166; hsa05168; hsa05170; hsa05205; hsa05310; hsa05321; hsa05322; hsa05323; hsa05330; hsa05332; hsa05410; hsa05414; hsa05418 1A8M; 1TNF; 2AZ5; 2E7A; 2TUN; 2ZJC; 2ZPX; 3ALQ; 3IT8; 3L9J; 3WD5; 4G3Y; 4TSV; 4TWT; 5TSW 18.1%
15 ODC1 P11926 Ornithine decarboxylase hsa00330; hsa00480; hsa01100 1D7K; 2ON3; 2OO0; 4ZGY 17.9%
16 CPB1 P15086 Carboxypeptidase B hsa04972; hsa04974 1KWM; 1ZLI 17.9%
17 BCL2L1 Q07817 Bcl-2-like protein 1 hsa01521; hsa01524; hsa04014; hsa04064; hsa04115; hsa04137; hsa04140; hsa04151; hsa04210; hsa04215; hsa04621; hsa04630; hsa05014; hsa05145; hsa05166; hsa05170; hsa05200; hsa05202; hsa05212; hsa05220; hsa05222; hsa05225 17.8%
18 RXRB P28702 Retinoic acid receptor RXR-beta hsa03320; hsa04659; hsa04919; hsa04920; hsa04928; hsa05200; hsa05202; hsa05216; hsa05222; hsa05223; hsa05226 1H9U; 1UHL 17.8%
19 PTGS1 P23219 Prostaglandin G/H synthase 1 hsa00590; hsa01100; hsa04611; hsa04726; hsa04923 NA 17.4%
20 MGMT P16455 Methylated-DNA--protein-cysteine methyltransferase NA 1EH6; 1EH7; 1EH8; 1QNT; 1T38; 1T39; 1YFH 17.3%


  logl

Reference:  Hongchun Li, Fen Pei, D. Lansing Taylor and Ivet Bahar. (2020) QuartataWeb: Integrated Chemical–Protein-Pathway Mapping for Polypharmacology and Chemogenomics. Bioinformatics 36(12), 3935–3937.

Contact:

The QuartataWeb server is maintained by the Bahar Lab at the Department of Computational & Systems Biology at the University of Pittsburgh, School of Medicine, and sponsored by the NIH awards P41 GM103712 and P01 DK096990; and by the Li Lab at Research Center for Computer-Aided Drug Discovery at Shenzhen Institutes of Advanced Technology, CAS.

For questions and comments please contact Hongchun Li.