Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | protease, serine, 1 (trypsin 1) | Starlite/ChEMBL | No references |
Homo sapiens | transmembrane protease, serine 15 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Trypsin family protein | protease, serine, 1 (trypsin 1) | 247 aa | 287 aa | 21.6 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Mycobacterium ulcerans | deoxyuridine 5'-triphosphate nucleotidohydrolase | 0.0115 | 0.3095 | 0.5 |
Brugia malayi | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Loa Loa (eye worm) | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Mycobacterium leprae | PROBABLE DEOXYCYTIDINE TRIPHOSPHATE DEAMINASE DCD (DCTP DEAMINASE) | 0.0115 | 0.3095 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0116 | 0.3126 | 0.3126 |
Toxoplasma gondii | deoxyuridine 5'-triphosphate nucleotidohydrolase, putative | 0.0331 | 1 | 0.5 |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase, mitochondrial precursor, putative | 0.0331 | 1 | 1 |
Schistosoma mansoni | deoxyuridine 5'-triphosphate nucleotidohydrolase | 0.0331 | 1 | 1 |
Brugia malayi | Trypsin family protein | 0.0116 | 0.3126 | 0.3126 |
Loa Loa (eye worm) | TK/ALK protein kinase | 0.0019 | 0.0044 | 0.0044 |
Entamoeba histolytica | hypothetical protein | 0.0331 | 1 | 1 |
Wolbachia endosymbiont of Brugia malayi | dUTPase | 0.0331 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0116 | 0.3126 | 0.3126 |
Schistosoma mansoni | subfamily S1A unassigned peptidase (S01 family) | 0.0116 | 0.3126 | 0.3126 |
Onchocerca volvulus | 0.0019 | 0.0044 | 0.014 | |
Schistosoma mansoni | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Trichomonas vaginalis | deoxyuridine 5'-triphosphate nucleotidohydrolase, putative | 0.0331 | 1 | 0.5 |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein | 0.0331 | 1 | 1 |
Plasmodium vivax | deoxyuridine 5'-triphosphate nucleotidohydrolase, putative | 0.0331 | 1 | 0.5 |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein | 0.0331 | 1 | 1 |
Treponema pallidum | deoxyuridine 5'-triphosphate nucleotidohydrolase (dut) | 0.0331 | 1 | 0.5 |
Entamoeba histolytica | hypothetical protein | 0.0216 | 0.6328 | 0.4682 |
Mycobacterium tuberculosis | Probable deoxycytidine triphosphate deaminase Dcd (dCTP deaminase) | 0.0115 | 0.3095 | 0.5 |
Onchocerca volvulus | 0.0106 | 0.2821 | 0.9025 | |
Entamoeba histolytica | hypothetical protein | 0.0331 | 1 | 1 |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase, mitochondrial precursor, putative | 0.0331 | 1 | 1 |
Mycobacterium ulcerans | deoxycytidine triphosphate deaminase | 0.0115 | 0.3095 | 0.5 |
Chlamydia trachomatis | deoxyuridine 5'-triphosphate nucleotidohydrolase | 0.0331 | 1 | 1 |
Entamoeba histolytica | hypothetical protein | 0.0216 | 0.6328 | 0.4682 |
Brugia malayi | Protein kinase domain containing protein | 0.0019 | 0.0044 | 0.0044 |
Plasmodium falciparum | deoxyuridine 5'-triphosphate nucleotidohydrolase | 0.0331 | 1 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Loa Loa (eye worm) | dUTP diphosphatase | 0.0331 | 1 | 1 |
Onchocerca volvulus | 0.0116 | 0.3126 | 1 | |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein | 0.0331 | 1 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Loa Loa (eye worm) | hypothetical protein | 0.0019 | 0.0044 | 0.0044 |
Echinococcus granulosus | dUTP pyrophosphatase | 0.0331 | 1 | 1 |
Onchocerca volvulus | 0.0019 | 0.0044 | 0.014 | |
Echinococcus multilocularis | dUTP pyrophosphatase | 0.0331 | 1 | 1 |
Entamoeba histolytica | deoxyuridine 5-triphosphate nucleotidohydrolase domain containing protein | 0.0331 | 1 | 1 |
Schistosoma mansoni | subfamily S1A unassigned peptidase (S01 family) | 0.0123 | 0.3339 | 0.3339 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Ki (binding) | = 1.53 nM | BindingDB_Patents: Inhibition Assay. Using a 96 well plate (#3915, Costar), a test compound (25 µL) was mixed with 20 µM fluorescence enzyme substrate (Boc-Phe-Ser-Arg-AMC, 50 µL) mixed with 200 mM Tris-HCl buffer (pH 8.0), and human trypsin (Sigma, 25 µL) was added. Using a fluorescence plate reader fmax (Molecular Devices, Inc.), the reaction rate was measured from the time-course changes at excitation wavelength 355 nm and fluorescence wavelength 460 nm. | ChEMBL. | No reference |
Ki (binding) | = 1.76 nM | BindingDB_Patents: Inhibition Assay. Using a 96 well plate (#3915, Costar), a test compound (25 µL), 400 mM Tris-HCl buffer (pH 8.0, 25 µL) and 0.5 mg/mL fluorescence enzyme substrate (Gly-Asp-Asp-Asp-Asp-Lys-ß-Naphtylamide, 25 µL) were mixed, and recombinant human enteropeptidase (R&D Systems, Inc., 25 µL) was added. Using a fluorescence plate reader fmax (Molecular Devices, Inc.), the reaction rate was measured from the time-course changes at excitation wavelength 320 nm and fluorescence wavelength 405 nm. | ChEMBL. | No reference |
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.