Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Bacillus anthracis | Anthrax lethal factor | Starlite/ChEMBL | No references |
Homo sapiens | caspase 7, apoptosis-related cysteine peptidase | Starlite/ChEMBL | No references |
Homo sapiens | caspase 1, apoptosis-related cysteine peptidase | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Cell death protein 3 precursor | caspase 7, apoptosis-related cysteine peptidase | 303 aa | 256 aa | 37.1 % |
Echinococcus granulosus | caspase 8 | caspase 1, apoptosis-related cysteine peptidase | 383 aa | 312 aa | 26.6 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Brugia malayi | Serine protease Z688.6 precursor | 0.0277 | 0.149 | 0.149 |
Echinococcus granulosus | caspase 3 apoptosis cysteine peptidase | 0.0141 | 0.0327 | 0.0327 |
Schistosoma mansoni | family S28 unassigned peptidase (S28 family) | 0.0277 | 0.149 | 0.149 |
Schistosoma mansoni | caspase-7 (C14 family) | 0.0141 | 0.0327 | 0.0327 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | prolylcarboxypeptidase, putative | 0.0277 | 0.149 | 0.5 |
Onchocerca volvulus | 0.0277 | 0.149 | 1 | |
Trypanosoma cruzi | serine carboxypeptidase S28, putative | 0.0277 | 0.149 | 0.5 |
Trypanosoma cruzi | putative prolyl carboxypeptidase, putative | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trypanosoma cruzi | serine carboxypeptidase S28, putative | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Schistosoma mansoni | caspase-3 (C14 family) | 0.0141 | 0.0327 | 0.0327 |
Toxoplasma gondii | serine carboxypeptidase s28 protein | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | lysosomal pro-X carboxypeptidase, putative | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.1267 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.1267 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0277 | 0.149 | 0.5 |
Echinococcus multilocularis | Lysosomal Pro X carboxypeptidase | 0.1267 | 1 | 1 |
Brugia malayi | Serine protease Z688.6 precursor | 0.0277 | 0.149 | 0.149 |
Echinococcus multilocularis | Lysosomal Pro X carboxypeptidase | 0.0277 | 0.149 | 0.149 |
Echinococcus multilocularis | caspase | 0.0141 | 0.0327 | 0.0327 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Echinococcus multilocularis | caspase 3, apoptosis cysteine peptidase | 0.0141 | 0.0327 | 0.0327 |
Loa Loa (eye worm) | hypothetical protein | 0.1267 | 1 | 1 |
Entamoeba histolytica | serine carboxypeptidase (S28) family protein | 0.0277 | 0.149 | 0.5 |
Giardia lamblia | Thymus-specific serine protease precursor | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Echinococcus granulosus | Lysosomal Pro X carboxypeptidase | 0.0277 | 0.149 | 0.149 |
Echinococcus granulosus | Lysosomal Pro X carboxypeptidase | 0.1267 | 1 | 1 |
Entamoeba histolytica | serine carboxypeptidase (S28) family protein | 0.0277 | 0.149 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0277 | 0.149 | 0.149 |
Entamoeba histolytica | serine carboxypeptidase (S28) family protein | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | prolylcarboxypeptidase, putative | 0.0277 | 0.149 | 0.5 |
Trichomonas vaginalis | Clan SC, family S28, unassigned serine peptidase | 0.0277 | 0.149 | 0.5 |
Giardia lamblia | Serine peptidase, putative | 0.0277 | 0.149 | 0.5 |
Echinococcus granulosus | caspase | 0.0141 | 0.0327 | 0.0327 |
Schistosoma mansoni | lysosomal Pro-Xaa carboxypeptidase (S28 family) | 0.1267 | 1 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Potency (functional) | = 2.5119 um | PUBCHEM_BIOASSAY: qHTS Assay for Anthrax Lethal Toxin Internalization. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 10 um | PUBCHEM_BIOASSAY: qHTS Assay for Allosteric/Competitive Inhibitors of Caspase-7. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 10 um | PUBCHEM_BIOASSAY: qHTS Assay for Allosteric/Competitive Inhibitors of Caspase-1. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 25.1189 um | PUBCHEM_BIOASSAY: qHTS Assay for Agonists of the Thyroid Stimulating Hormone Receptor. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 31.6228 um | PUBCHEM_BIOASSAY: qHTS Screen for Compounds that Selectively Target Cancer Cells with p53 Mutations: Cytotoxicity of p53ts Cells at the Nonpermissive Temperature. (Class of assay: confirmatory) | 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.