Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | potassium voltage-gated channel, subfamily H (eag-related), member 2 | Starlite/ChEMBL | References |
Staphylococcus aureus | DNA gyrase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Leishmania major | DNA topoisomerase ii | DNA gyrase | 644 aa | 672 aa | 23.4 % |
Leishmania major | mitochondrial DNA topoisomerase II | DNA gyrase | 644 aa | 624 aa | 23.1 % |
Echinococcus multilocularis | DNA topoisomerase 2 alpha | DNA gyrase | 644 aa | 612 aa | 25.8 % |
Leishmania braziliensis | mitochondrial DNA topoisomerase II | DNA gyrase | 644 aa | 622 aa | 23.8 % |
Mycobacterium tuberculosis | DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) | DNA gyrase | 644 aa | 661 aa | 53.0 % |
Brugia malayi | DNA topoisomerase II, alpha isozyme | DNA gyrase | 644 aa | 659 aa | 24.3 % |
Trypanosoma brucei | DNA topoisomerase ii | DNA gyrase | 644 aa | 619 aa | 25.7 % |
Leishmania donovani | mitochondrial DNA topoisomerase II | DNA gyrase | 644 aa | 624 aa | 23.2 % |
Plasmodium berghei | DNA gyrase subunit B, putative | DNA gyrase | 644 aa | 662 aa | 36.3 % |
Leishmania infantum | mitochondrial DNA topoisomerase II | DNA gyrase | 644 aa | 624 aa | 23.2 % |
Mycobacterium ulcerans | DNA gyrase subunit B | DNA gyrase | 644 aa | 663 aa | 54.0 % |
Trypanosoma cruzi | mitochondrial DNA topoisomerase II, putative | DNA gyrase | 644 aa | 615 aa | 22.6 % |
Dictyostelium discoideum | DNA topoisomerase II | DNA gyrase | 644 aa | 655 aa | 23.8 % |
Leishmania mexicana | DNA topoisomerase ii | DNA gyrase | 644 aa | 668 aa | 23.1 % |
Toxoplasma gondii | DNA topoisomerase 2, putative | DNA gyrase | 644 aa | 664 aa | 24.1 % |
Echinococcus granulosus | DNA topoisomerase 2 alpha | DNA gyrase | 644 aa | 613 aa | 25.9 % |
Neospora caninum | hypothetical protein | DNA gyrase | 644 aa | 693 aa | 24.1 % |
Leishmania mexicana | mitochondrial DNA topoisomerase II | DNA gyrase | 644 aa | 620 aa | 23.4 % |
Loa Loa (eye worm) | TOPoisomerase family member | DNA gyrase | 644 aa | 668 aa | 26.2 % |
Mycobacterium leprae | Probable DNA gyrase (subunit B) GyrB (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) | DNA gyrase | 644 aa | 667 aa | 53.1 % |
Candida albicans | DNA topoisomerase II similar to S. cerevisiae TOP2 (YNL088W) | DNA gyrase | 644 aa | 625 aa | 25.6 % |
Wolbachia endosymbiont of Brugia malayi | DNA gyrase, topoisomerase II, B subunit, GyrB | DNA gyrase | 644 aa | 561 aa | 50.4 % |
Trypanosoma cruzi | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 674 aa | 23.0 % |
Trypanosoma brucei | DNA topoisomerase II alpha, putative | DNA gyrase | 644 aa | 676 aa | 23.4 % |
Trypanosoma congolense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 678 aa | 22.7 % |
Trypanosoma congolense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 617 aa | 24.8 % |
Onchocerca volvulus | DNA gyrase | 644 aa | 624 aa | 25.8 % | |
Trypanosoma cruzi | mitochondrial DNA topoisomerase II, putative | DNA gyrase | 644 aa | 615 aa | 22.6 % |
Trypanosoma brucei | DNA topoisomerase II beta, putative | DNA gyrase | 644 aa | 570 aa | 24.0 % |
Candida albicans | DNA topoisomerase II similar to S. cerevisiae TOP2 (YNL088W) | DNA gyrase | 644 aa | 625 aa | 25.6 % |
Chlamydia trachomatis | DNA gyrase subunit B | DNA gyrase | 644 aa | 561 aa | 55.3 % |
Onchocerca volvulus | Ectoderm-expressed 4 homolog | DNA gyrase | 644 aa | 673 aa | 24.1 % |
Leishmania infantum | DNA topoisomerase ii | DNA gyrase | 644 aa | 666 aa | 23.6 % |
Schistosoma mansoni | DNA topoisomerase II | DNA gyrase | 644 aa | 633 aa | 24.3 % |
Trypanosoma congolense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 678 aa | 22.9 % |
Leishmania donovani | DNA topoisomerase ii | DNA gyrase | 644 aa | 666 aa | 23.4 % |
Plasmodium knowlesi | DNA gyrase subunit B, putative | DNA gyrase | 644 aa | 517 aa | 36.0 % |
Brugia malayi | Probable DNA topoisomerase II | DNA gyrase | 644 aa | 672 aa | 25.9 % |
Babesia bovis | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 587 aa | 22.7 % |
Theileria parva | DNA gyrase subunit B, putative | DNA gyrase | 644 aa | 638 aa | 37.1 % |
Entamoeba histolytica | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 544 aa | 25.0 % |
Leishmania braziliensis | DNA topoisomerase ii | DNA gyrase | 644 aa | 675 aa | 23.0 % |
Onchocerca volvulus | DNA gyrase | 644 aa | 618 aa | 26.5 % | |
Trypanosoma brucei gambiense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 619 aa | 25.7 % |
Trypanosoma brucei gambiense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 666 aa | 23.4 % |
Trypanosoma cruzi | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 674 aa | 23.0 % |
Theileria parva | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 683 aa | 23.9 % |
Trypanosoma brucei gambiense | DNA topoisomerase II, putative | DNA gyrase | 644 aa | 676 aa | 23.4 % |
Brugia malayi | DNA gyrase/topoisomerase IV, A subunit family protein | DNA gyrase | 644 aa | 548 aa | 25.7 % |
Plasmodium falciparum | DNA topoisomerase 2 | DNA gyrase | 644 aa | 647 aa | 23.2 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | hypothetical protein | 0.0039 | 0.2089 | 0.3402 |
Echinococcus granulosus | Basic leucine zipper bZIP transcription factor | 0.0091 | 0.6342 | 1 |
Echinococcus granulosus | potassium voltage gated channel subfamily H | 0.0045 | 0.2566 | 0.4046 |
Loa Loa (eye worm) | hypothetical protein | 0.0018 | 0.039 | 0.0635 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0042 | 0.2328 | 1 |
Echinococcus multilocularis | Basic leucine zipper (bZIP) transcription factor | 0.0091 | 0.6342 | 1 |
Brugia malayi | DNA topoisomerase II, alpha isozyme | 0.004 | 0.217 | 0.3421 |
Brugia malayi | Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog | 0.0045 | 0.2566 | 0.4046 |
Schistosoma mansoni | hypothetical protein | 0.0039 | 0.2119 | 0.4274 |
Echinococcus granulosus | Basic leucine zipper bZIP transcription | 0.0039 | 0.2119 | 0.3341 |
Trypanosoma cruzi | mitochondrial DNA topoisomerase II, putative | 0.004 | 0.217 | 1 |
Echinococcus multilocularis | DNA topoisomerase 2 alpha | 0.004 | 0.217 | 0.3421 |
Mycobacterium tuberculosis | DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (type II DNA topoisomerase) | 0.0136 | 1 | 1 |
Trypanosoma brucei | DNA topoisomerase ii | 0.004 | 0.217 | 1 |
Echinococcus multilocularis | Basic leucine zipper (bZIP) transcription | 0.0039 | 0.2119 | 0.3341 |
Brugia malayi | DNA gyrase/topoisomerase IV, A subunit family protein | 0.004 | 0.217 | 0.3421 |
Brugia malayi | bZIP transcription factor family protein | 0.0091 | 0.6342 | 1 |
Loa Loa (eye worm) | TOPoisomerase family member | 0.004 | 0.217 | 0.3534 |
Loa Loa (eye worm) | hypothetical protein | 0.0014 | 0.01 | 0.0164 |
Brugia malayi | Probable DNA topoisomerase II | 0.004 | 0.217 | 0.3421 |
Schistosoma mansoni | transcription factor LCR-F1 | 0.0039 | 0.2119 | 0.4274 |
Loa Loa (eye worm) | hypothetical protein | 0.0014 | 0.01 | 0.0164 |
Mycobacterium ulcerans | DNA gyrase subunit A | 0.0136 | 1 | 1 |
Chlamydia trachomatis | DNA gyrase subunit B | 0.0072 | 0.476 | 0.4707 |
Schistosoma mansoni | hypothetical protein | 0.0074 | 0.4958 | 1 |
Loa Loa (eye worm) | voltage and ligand gated potassium channel | 0.0045 | 0.2566 | 0.4179 |
Trypanosoma cruzi | mitochondrial DNA topoisomerase II, putative | 0.004 | 0.217 | 1 |
Schistosoma mansoni | voltage-gated potassium channel | 0.0049 | 0.2897 | 0.5845 |
Echinococcus granulosus | jun protein | 0.0091 | 0.6342 | 1 |
Toxoplasma gondii | DNA gyrase/topoisomerase IV, A subunit domain-containing protein | 0.0136 | 1 | 1 |
Giardia lamblia | DNA topoisomerase II | 0.0036 | 0.1892 | 0.5 |
Schistosoma mansoni | jun-related protein | 0.0074 | 0.4958 | 1 |
Wolbachia endosymbiont of Brugia malayi | DNA gyrase subunit A | 0.0136 | 1 | 1 |
Brugia malayi | hypothetical protein | 0.0039 | 0.2119 | 0.3341 |
Leishmania major | mitochondrial DNA topoisomerase II | 0.004 | 0.217 | 1 |
Schistosoma mansoni | DNA topoisomerase II | 0.004 | 0.217 | 0.4377 |
Echinococcus multilocularis | potassium voltage gated channel subfamily H | 0.0045 | 0.2566 | 0.4046 |
Toxoplasma gondii | DNA topoisomerase 2, putative | 0.004 | 0.217 | 0.1278 |
Onchocerca volvulus | 0.0072 | 0.4755 | 1 | |
Schistosoma mansoni | voltage-gated potassium channel | 0.0049 | 0.2897 | 0.5845 |
Loa Loa (eye worm) | hypothetical protein | 0.0018 | 0.039 | 0.0635 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0042 | 0.2328 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0089 | 0.6139 | 1 |
Plasmodium vivax | DNA gyrase subunit B, putative | 0.0072 | 0.476 | 0.3308 |
Plasmodium falciparum | DNA gyrase subunit A | 0.0136 | 1 | 1 |
Chlamydia trachomatis | DNA gyrase subunit B | 0.0072 | 0.476 | 0.4707 |
Treponema pallidum | DNA gyrase, subunit A (gyrA) | 0.0136 | 1 | 1 |
Mycobacterium leprae | Probable DNA gyrase (subunit A) GyrA (DNA topoisomerase (ATP-hydrolysing)) (DNA topoisomerase II) (Type II DNA topoisomerase) | 0.0065 | 0.4219 | 0.5 |
Plasmodium vivax | DNA gyrase subunit A, putative | 0.0136 | 1 | 1 |
Brugia malayi | hypothetical protein | 0.0072 | 0.4755 | 0.7498 |
Echinococcus multilocularis | jun protein | 0.0091 | 0.6342 | 1 |
Entamoeba histolytica | DNA topoisomerase II, putative | 0.004 | 0.217 | 1 |
Echinococcus granulosus | DNA topoisomerase 2 alpha | 0.004 | 0.217 | 0.3421 |
Plasmodium falciparum | DNA gyrase subunit B | 0.0072 | 0.476 | 0.3308 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
AUC/dose (ADMET) | = 0.76 uM.hr | Dose normalized AUC in C57BL/6 mouse at 1 mg/kg, iv and 2 mg/kg, po | ChEMBL. | 24900889 |
ED50 (functional) | = 23 mg kg-1 | Antibacterial activity against Escherichia coli infected in iv dosed ICR mouse assessed as increase in mouse survival after 7 days | ChEMBL. | 24900889 |
Fu (ADMET) | > 25 % | Unbound fraction in human plasma | ChEMBL. | 24900889 |
IC50 (binding) | = 1.02 uM | Inhibition of Staphylococcus aureus DNA gyrase | ChEMBL. | 24900889 |
IC50 (binding) | = 18 uM | Inhibition of human ERG expressed in CHO cells by automated patch clamp assay | ChEMBL. | 24900889 |
Many chemical entities in TDR Targets come from high-throughput screenings with whole cells or tissue samples, and not all assayed compounds have been tested against a single a single target protein, probably because they get ruled out during screening process. Even if these compounds may have not been of interest in the original screening, they may come as interesting leads for other screening assays. Furthermore, we may be able to propose drug-target associations using chemical similarities and network patterns.
1 literature reference was collected for this gene.