Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Rattus norvegicus | Peripheral-type benzodiazepine receptor | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Echinococcus granulosus | vacuolar h atpase | Peripheral-type benzodiazepine receptor | 169 aa | 137 aa | 25.5 % |
Onchocerca volvulus | Peripheral-type benzodiazepine receptor | 169 aa | 156 aa | 25.6 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | 6-phosphofructokinase | 0.173 | 1 | 1 |
Echinococcus multilocularis | 6 phosphofructo 2 kinase:fructose 2 | 0.173 | 1 | 1 |
Trypanosoma brucei | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.173 | 1 | 1 |
Onchocerca volvulus | 0.173 | 1 | 1 | |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Leishmania major | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.17 | 0.9796 | 0.9796 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.173 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.173 | 1 | 1 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.0738 | 0.3086 | 0.3086 |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Toxoplasma gondii | histone deacetylase HDAC2 | 0.0296 | 0 | 0.5 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase 1 | 0.17 | 0.9796 | 0.9796 |
Loa Loa (eye worm) | hypothetical protein | 0.0322 | 0.0184 | 0.0184 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.173 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.17 | 0.9796 | 0.9796 |
Trichomonas vaginalis | histone deacetylase 1, 2 ,3, putative | 0.0296 | 0 | 0.5 |
Toxoplasma gondii | histone deacetylase HDAC3 | 0.0296 | 0 | 0.5 |
Plasmodium vivax | histone deacetylase 1, putative | 0.0296 | 0 | 0.5 |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Mycobacterium ulcerans | hypothetical protein | 0.1021 | 0.5057 | 1 |
Trypanosoma brucei | 6-phosphofructo-2-kinase 2 | 0.17 | 0.9796 | 0.9796 |
Giardia lamblia | Hypothetical protein | 0.1021 | 0.5057 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0322 | 0.0184 | 0.0184 |
Entamoeba histolytica | phosphoglycerate mutase family protein, putative | 0.1021 | 0.5057 | 1 |
Leishmania major | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.173 | 1 | 1 |
Trypanosoma brucei | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.0738 | 0.3086 | 0.3086 |
Plasmodium falciparum | histone deacetylase 1 | 0.0296 | 0 | 0.5 |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0322 | 0.0184 | 0.0184 |
Trichomonas vaginalis | histone deacetylase 1, 2 ,3, putative | 0.0296 | 0 | 0.5 |
Echinococcus multilocularis | translocator protein | 0.0322 | 0.0184 | 0.0184 |
Loa Loa (eye worm) | hypothetical protein | 0.0992 | 0.4854 | 0.4854 |
Leishmania major | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase-1-like protein | 0.0738 | 0.3086 | 0.3086 |
Giardia lamblia | Hypothetical protein | 0.1021 | 0.5057 | 1 |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Mycobacterium ulcerans | fructose-2,6-bisphosphatase GpmB | 0.1021 | 0.5057 | 1 |
Brugia malayi | TspO/MBR family protein | 0.0322 | 0.0184 | 1 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase/fructose-2,6-biphosphatase, putative | 0.0738 | 0.3086 | 0.3086 |
Trichomonas vaginalis | histone deacetylase, putative | 0.0296 | 0 | 0.5 |
Schistosoma mansoni | peripheral-type benzodiazepine receptor | 0.0322 | 0.0184 | 0.0184 |
Loa Loa (eye worm) | hypothetical protein | 0.0322 | 0.0184 | 0.0184 |
Trypanosoma cruzi | 6-phosphofructo-2-kinase 1 | 0.17 | 0.9796 | 0.9796 |
Echinococcus granulosus | translocator protein | 0.0322 | 0.0184 | 0.0184 |
Trichomonas vaginalis | histone deacetylase 1, 2 ,3, putative | 0.0296 | 0 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Ki (binding) | = 0.29 nM | Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates | ChEMBL. | 23489633 |
Ki (binding) | = 0.37 nM | Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates | ChEMBL. | 23489633 |
Ki (binding) | = 0.37 nM | In Vitro Potency Assay | BINDINGDB. | No reference |
Ki (binding) | = 1.17 nM | Displacement of [3H]PK11195 from PBR receptor in Wistar rat heart homogenates | ChEMBL. | 23489633 |
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.