Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Echinococcus multilocularis | FTZ F1 alpha | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | ecdysone induced protein 78C | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | steroid hormone receptor ad4bp | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-1 | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | thyroid hormone receptor | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | nuclear hormone receptor | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Onchocerca volvulus | 0.0041 | 0.5 | 0.5 | |
Schistosoma mansoni | RAR-like nuclear receptor | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | nuclear receptor 2DBD gamma | 0.0041 | 0.5 | 0.5 |
Onchocerca volvulus | Steroid hormone receptor family member cnr14 homolog | 0.0041 | 0.5 | 0.5 |
Brugia malayi | steroid hormone receptor | 0.0041 | 0.5 | 0.5 |
Brugia malayi | nuclear receptor NHR-88 | 0.0041 | 0.5 | 0.5 |
Onchocerca volvulus | Bile acid receptor homolog | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Steroid receptor seven-up type 2 | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | Tr4/Tr2 (homologue) | 0.0041 | 0.5 | 0.5 |
Brugia malayi | nuclear hormone receptor | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear Hormone Receptor family member | 0.0041 | 0.5 | 0.5 |
Onchocerca volvulus | Protein ultraspiracle homolog | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-19 | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | COUP TF:Svp nuclear hormone receptor | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-41 | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-14 | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | retinoic acid receptor rxr beta a | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-40 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | hepatocyte nuclear factor 4 alpha | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Ligand-binding domain of nuclear hormone receptor family protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-14 | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-3 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | Nuclear hormone receptor family member nhr 41 | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-41 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | COUP TF:Svp nuclear hormone receptor | 0.0041 | 0.5 | 0.5 |
Brugia malayi | photoreceptor-specific nuclear receptor | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | FTZ F1 alpha | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | coup transcription factor | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-25 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | nuclear receptor 2DBD gamma | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | photoreceptor-specific nuclear receptor related | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | thyroid hormone receptor | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-1 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | nuclear receptor 2DBD gamma | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | ecdysone induced protein 78C | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | nuclear hormone receptor nor-1/nor-2 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | thyroid hormone receptor alpha | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | Nuclear hormone receptor family member nhr 41 | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | nuclear receptor 2DBD gamma | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | FTZ F1 nuclear receptor protein | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | retinoid-x-receptor (RXR) | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-19 | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | nuclear receptor 2DBD-gamma | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-25 | 0.0041 | 0.5 | 0.5 |
Echinococcus multilocularis | FTZ F1 nuclear receptor protein | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-49 | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Ligand-binding domain of nuclear hormone receptor family protein | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-40 | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | FTZ-F1 nuclear receptor-like protein | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | steroid hormone receptor | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-49 | 0.0041 | 0.5 | 0.5 |
Schistosoma mansoni | retinoic acid receptor RXR | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-31 | 0.0041 | 0.5 | 0.5 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-31 | 0.0041 | 0.5 | 0.5 |
Echinococcus granulosus | hepatocyte nuclear factor 4 alpha | 0.0041 | 0.5 | 0.5 |
Brugia malayi | Nuclear hormone receptor-like 1 | 0.0041 | 0.5 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Activity (functional) | = 1 % | Induction of apoptosis in human MDA-MB-435 cells assessed as apoptotic cells at 10 uM after 24 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 1 % | Induction of apoptosis in human MDA-MB-435 cells assessed as apoptotic cells at 10 uM after 48 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 2 % | Induction of apoptosis in human MDA-MB-435 cells assessed as pre-necrotic cells at 10 uM after 24 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 4 % | Induction of apoptosis in human MDA-MB-435 cells assessed as necrotic cells at 10 uM after 24 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 10 % | Induction of apoptosis in human MDA-MB-435 cells assessed as pre-necrotic cells at 10 uM after 48 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 37 % | Induction of apoptosis in human MDA-MB-435 cells assessed as necrotic cells at 10 uM after 48 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 52 % | Induction of apoptosis in human MDA-MB-435 cells assessed as viable cells at 10 uM after 48 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (functional) | = 93 % | Induction of apoptosis in human MDA-MB-435 cells assessed as viable cells at 10 uM after 24 hrs using by annexin V and propidium iodide staining by flow cytometry relative to control | ChEMBL. | 21443194 |
Activity (ADMET) | = 29 g | Toxicity in human MDA-MB-435 cells xenografted athymic nude mouse assessed as change in doy weight at 10 mg/kg, ip for 9 days followed by 20 mg/kg, ip for 5 days followed by 40 mg/kg, ip for 12 days | ChEMBL. | 21443194 |
IC50 (functional) | = 0.2 uM | Cytotoxicity against human NCI/ADR-RES cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | = 0.6 uM | Cytotoxicity against human 5637 cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | = 5.2 uM | Cytotoxicity against human HEY cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | = 6.3 uM | Cytotoxicity against human MDA-MB-435 cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | = 7.2 uM | Cytotoxicity against human HT-29 cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | = 8.8 uM | Cytotoxicity against p53 deficient human HCT116 cells expressing p53 after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | > 10 uM | Cytotoxicity against human HCT116 cells expressing p53 after 72 hrs by MTT assay | ChEMBL. | 21443194 |
IC50 (functional) | > 20 uM | Cytotoxicity against human UM-UC-3 cells after 72 hrs by MTT assay | ChEMBL. | 21443194 |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Homo sapiens | ChEMBL23 | 21443194 |
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.