QuartataWeb
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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: target; # of requested predictions: 20; Secondary interactions: no
Input target 1: Q969P6
No. Gene UniProt ID Protein Name Pathway PDB
1 TOP1MT Q969P6 DNA topoisomerase I, mitochondrial NA NA


2 known interactions (drugs) of input target (TOP1MT): DNA topoisomerase I, mitochondrial
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image
1 Approved;
Investigational		 SmallMoleculeDrug DB00762 Irinotecan Thumb
2 Approved;
Investigational		 SmallMoleculeDrug DB01030 Topotecan Thumb


20 predicted interactions (drugs) of input target (TOP1MT): DNA topoisomerase I, mitochondrial
No. Group Type Drug ID Drug Name SMILES
⇨ TargetHunter		 Image Confidence score
1 Approved SmallMoleculeDrug DB11254 Hexylresorcinol Thumb 22.3%
2 Approved;
Investigational		 SmallMoleculeDrug DB05630 Sodium stibogluconate Thumb 22.2%
3 Experimental SmallMoleculeDrug DB07354 2,3-DIMETHOXY-12H-[1,3]DIOXOLO[5,6]INDENO[1,2-C]ISOQUINOLIN-6-IUM Thumb 21.9%
4 Experimental SmallMoleculeDrug DB08159 4-(5,11-DIOXO-5H-INDENO[1,2-C]ISOQUINOLIN-6(11H)-YL)BUTANOATE Thumb 21.7%
5 Investigational SmallMoleculeDrug DB05482 7-ethyl-10-hydroxycamptothecin Thumb 19.8%
6 Investigational SmallMoleculeDrug DB06069 XMT-1001 Thumb 18.2%
7 Investigational SmallMoleculeDrug DB04882 Edotecarin Thumb 17.7%
8 Investigational SmallMoleculeDrug DB05806 Cositecan Thumb 17.6%
9 Experimental SmallMoleculeDrug DB04690 Camptothecin Thumb 16.7%
10 Approved;
Vet approved		 SmallMoleculeDrug DB08818 Hyaluronic acid Thumb 15.8%
11 Investigational SmallMoleculeDrug DB05129 Elsamitrucin Thumb 15.7%
12 Approved;
Investigational		 SmallMoleculeDrug DB04967 Lucanthone Thumb 15.5%
13 Investigational SmallMoleculeDrug DB06159 Rubitecan Thumb 14.7%
14 Approved;
Nutraceutical		 SmallMoleculeDrug DB00139 Succinic acid Thumb 13.8%
15 Approved;
Nutraceutical		 SmallMoleculeDrug DB00157 NADH Thumb 13.8%
16 Experimental SmallMoleculeDrug DB03963 S-(Dimethylarsenic)Cysteine Thumb 13.8%
17 Experimental SmallMoleculeDrug DB02405 12-Bromododecanoic Acid Thumb 13.4%
18 Approved SmallMoleculeDrug DB01349 Tasosartan Thumb 13.3%
19 Approved;
Experimental		 SmallMoleculeDrug DB03796 Palmitic Acid Thumb 13.3%
20 Experimental SmallMoleculeDrug DB06980 (2S)-2-(1H-indol-3-yl)hexanoic acid Thumb 13.2%


  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.