Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Brugia malayi | Protein-tyrosine phosphatase containing protein | 0.1145 | 0.2564 | 0.2564 |
Trichomonas vaginalis | 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative | 0.1923 | 0.4523 | 1 |
Mycobacterium ulcerans | hydroxymethylglutaryl-coenzyme a (HMG-CoA) reductase | 0.4099 | 1 | 0.5 |
Loa Loa (eye worm) | abnormal chemotaxis protein 14 | 0.1688 | 0.393 | 0.393 |
Trichomonas vaginalis | Sialidase-1 precursor, putative | 0.1132 | 0.2532 | 0.3513 |
Leishmania major | 3-hydroxy-3-methylglutaryl-CoA reductase | 0.4099 | 1 | 0.5 |
Trypanosoma cruzi | 3-hydroxy-3-methylglutaryl-CoA reductase | 0.4099 | 1 | 1 |
Brugia malayi | CHE-14 protein | 0.1688 | 0.393 | 0.393 |
Schistosoma mansoni | patched 1 | 0.1688 | 0.393 | 0.1837 |
Trichomonas vaginalis | conserved hypothetical protein | 0.1688 | 0.393 | 0.8068 |
Echinococcus multilocularis | Niemann Pick C1 protein | 0.1688 | 0.393 | 0.1837 |
Trichomonas vaginalis | 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative | 0.1923 | 0.4523 | 1 |
Echinococcus multilocularis | protein dispatched 1 | 0.1688 | 0.393 | 0.1837 |
Schistosoma mansoni | niemann-pick C1 (NPC1) | 0.1688 | 0.393 | 0.1837 |
Schistosoma mansoni | hydroxymethylglutaryl-CoA reductase (NADPH) | 0.4099 | 1 | 1 |
Echinococcus granulosus | hydroxymethylglutaryl coenzyme A reductase | 0.4099 | 1 | 1 |
Echinococcus multilocularis | protein patched | 0.1688 | 0.393 | 0.1837 |
Echinococcus multilocularis | hydroxymethylglutaryl coenzyme A reductase | 0.4099 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.1688 | 0.393 | 0.393 |
Trypanosoma brucei | 3-hydroxy-3-methylglutaryl-CoA reductase, putative | 0.4099 | 1 | 1 |
Loa Loa (eye worm) | protein-tyrosine phosphatase | 0.1145 | 0.2564 | 0.2564 |
Trypanosoma cruzi | 3-hydroxy-3-methylglutaryl-CoA reductase, putative | 0.4099 | 1 | 1 |
Trichomonas vaginalis | 3-hydroxy-3-methylglutaryl-coenzyme A reductase, putative | 0.1923 | 0.4523 | 1 |
Echinococcus granulosus | Niemann Pick C1 protein | 0.1688 | 0.393 | 0.1837 |
Giardia lamblia | 3-hydroxy-3-methylglutaryl-coenzyme A reductase | 0.1923 | 0.4523 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.1132 | 0.2532 | 0.3513 |
Echinococcus granulosus | Protein patched homolog 1 | 0.1688 | 0.393 | 0.1837 |
Loa Loa (eye worm) | hypothetical protein | 0.4099 | 1 | 1 |
Echinococcus granulosus | sterol regulatory element binding protein | 0.1688 | 0.393 | 0.1837 |
Echinococcus multilocularis | sterol regulatory element binding protein | 0.1688 | 0.393 | 0.1837 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (functional) | = 19.1 uM | Cytotoxicity against human MDA-MB-231 cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
IC50 (functional) | = 58.4 uM | Cytotoxicity against human DU145 cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
IC50 (functional) | = 66.4 uM | Cytotoxicity against human LNCAP cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
IC50 (functional) | = 95.4 uM | Cytotoxicity against human PC3 cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
IC50 (functional) | = 594.7 uM | Cytotoxicity against human MCF7 cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
IC50 (functional) | > 1000 uM | Cytotoxicity against human MIAPaCa2 cells after 48 hrs by MTT assay | ChEMBL. | 20692741 |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Homo sapiens | ChEMBL23 | 20692741 |
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.