Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | caspase 3, apoptosis-related cysteine peptidase | Starlite/ChEMBL | References |
Homo sapiens | caspase 6, apoptosis-related cysteine peptidase | Starlite/ChEMBL | References |
Homo sapiens | caspase 8, apoptosis-related cysteine peptidase | Starlite/ChEMBL | References |
Homo sapiens | caspase 7, apoptosis-related cysteine peptidase | Starlite/ChEMBL | References |
Homo sapiens | caspase 1, apoptosis-related cysteine peptidase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Echinococcus granulosus | caspase 8 | caspase 1, apoptosis-related cysteine peptidase | 383 aa | 312 aa | 26.6 % |
Brugia malayi | Cell death protein 3 precursor | caspase 7, apoptosis-related cysteine peptidase | 303 aa | 256 aa | 37.1 % |
Brugia malayi | Cell death protein 3 precursor | caspase 6, apoptosis-related cysteine peptidase | 293 aa | 270 aa | 34.4 % |
Brugia malayi | Cell death protein 3 precursor | caspase 3, apoptosis-related cysteine peptidase | 277 aa | 253 aa | 38.7 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Plasmodium vivax | beta-hydroxyacyl-ACP dehydratase precursor, putative | 0.0228 | 0.5089 | 1 |
Trypanosoma cruzi | metacaspase, putative | 0.0139 | 0.0025 | 1 |
Trypanosoma cruzi | metacaspase 5, putative | 0.0139 | 0.0025 | 1 |
Echinococcus multilocularis | caspase 8 | 0.0139 | 0.0025 | 0.0025 |
Brugia malayi | Cell death protein 3 precursor | 0.0189 | 0.2851 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0139 | 0.0025 | 0.0089 |
Trypanosoma cruzi | metacaspase, putative | 0.0139 | 0.0025 | 1 |
Trypanosoma cruzi | metacaspase 5, putative | 0.0139 | 0.0025 | 1 |
Trypanosoma brucei | metacaspase MCA3 | 0.0139 | 0.0025 | 1 |
Mycobacterium tuberculosis | NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) | 0.0187 | 0.2771 | 0.5 |
Echinococcus granulosus | caspase | 0.0315 | 1 | 1 |
Toxoplasma gondii | beta-hydroxyacyl-acyl carrier protein dehydratase (FABZ) | 0.0228 | 0.5089 | 1 |
Trypanosoma brucei | metacaspase | 0.0139 | 0.0025 | 1 |
Wolbachia endosymbiont of Brugia malayi | (3R)-hydroxymyristoyl-ACP dehydratase | 0.0228 | 0.5089 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0189 | 0.2851 | 1 |
Mycobacterium ulcerans | enoyl-(acyl carrier protein) reductase | 0.0187 | 0.2771 | 1 |
Mycobacterium leprae | NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) | 0.0187 | 0.2771 | 0.5 |
Trypanosoma brucei | metacaspase 5, putative | 0.0139 | 0.0025 | 1 |
Trichomonas vaginalis | hypothetical protein | 0.0187 | 0.2771 | 1 |
Echinococcus granulosus | caspase 3 | 0.0176 | 0.2112 | 0.2112 |
Toxoplasma gondii | enoyl-acyl carrier reductase ENR | 0.0187 | 0.2771 | 0.5422 |
Echinococcus multilocularis | caspase 3, apoptosis cysteine peptidase | 0.0315 | 1 | 1 |
Trypanosoma brucei | metacaspase MCA2 | 0.0139 | 0.0025 | 1 |
Echinococcus multilocularis | caspase 2 | 0.0189 | 0.2851 | 0.2851 |
Plasmodium falciparum | beta-hydroxyacyl-ACP dehydratase | 0.0228 | 0.5089 | 1 |
Schistosoma mansoni | subfamily C14A unassigned peptidase (C14 family) | 0.0139 | 0.0025 | 0.0025 |
Echinococcus granulosus | caspase 8 | 0.0139 | 0.0025 | 0.0025 |
Schistosoma mansoni | caspase-7 (C14 family) | 0.0315 | 1 | 1 |
Trypanosoma cruzi | metacaspase, putative | 0.0139 | 0.0025 | 1 |
Trypanosoma cruzi | metacaspase, putative | 0.0139 | 0.0025 | 1 |
Plasmodium falciparum | enoyl-acyl carrier reductase | 0.0187 | 0.2771 | 0.5422 |
Echinococcus multilocularis | caspase | 0.0315 | 1 | 1 |
Brugia malayi | mucosa associated lymphoid tissue lymphoma translocation protein 1 | 0.0139 | 0.0025 | 0.0089 |
Echinococcus multilocularis | caspase 3 | 0.0176 | 0.2112 | 0.2112 |
Plasmodium vivax | enoyl-acyl carrier protein reductase | 0.0187 | 0.2771 | 0.5422 |
Schistosoma mansoni | caspase-7 (C14 family) | 0.0189 | 0.2851 | 0.2851 |
Schistosoma mansoni | caspase-3 (C14 family) | 0.0315 | 1 | 1 |
Echinococcus granulosus | caspase 2 | 0.0189 | 0.2851 | 0.2851 |
Trypanosoma brucei | Metacaspase-4 | 0.0139 | 0.0025 | 1 |
Onchocerca volvulus | Cell death protein 3 homolog | 0.0189 | 0.2851 | 0.5 |
Leishmania major | metacaspase, putative | 0.0139 | 0.0025 | 1 |
Chlamydia trachomatis | 3-hydroxyacyl-ACP dehydratase | 0.0228 | 0.5089 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 0.543 uM | Inhibition of caspase-1 | ChEMBL. | 12270185 |
IC50 (binding) | = 0.543 uM | Inhibition of caspase-1 | ChEMBL. | 12270185 |
IC50 (binding) | = 1.42 uM | Inhibitory concentration against caspase-3 | ChEMBL. | 12270185 |
IC50 (binding) | = 1.42 uM | Inhibitory concentration against caspase-3 | ChEMBL. | 12270185 |
IC50 (binding) | = 5.23 uM | Inhibitory concentration against caspase-8 | ChEMBL. | 12270185 |
IC50 (binding) | = 5.23 uM | Inhibitory concentration against caspase-8 | ChEMBL. | 12270185 |
IC50 (binding) | = 7.43 uM | Inhibitory concentration against caspase-7 | ChEMBL. | 12270185 |
IC50 (binding) | = 7.43 uM | Inhibitory concentration against caspase-7 | ChEMBL. | 12270185 |
IC50 (binding) | = 10.3 uM | Inhibitory concentration required against caspase-6 | ChEMBL. | 12270185 |
IC50 (binding) | = 10.3 uM | Inhibitory concentration required against caspase-6 | ChEMBL. | 12270185 |
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.