Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Clostridium botulinum | Botulinum neurotoxin type A | Starlite/ChEMBL | References |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Brugia malayi | Bromodomain containing protein | 0.151883 | 1 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.151883 | 1 | 1 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.151883 | 1 | 1 |
Schistosoma mansoni | bromodomain-containing protein 3 brd3 | 0.151883 | 1 | 0.5 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0934332 | 0.313253 | 0.313253 |
Toxoplasma gondii | bromodomain-containing protein | 0.0667717 | 0 | 0.5 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.1252 | 1 | 1 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.1252 | 1 | 1 |
Echinococcus multilocularis | bromodomain containing 2 | 0.1252 | 1 | 1 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0777 | 0.3163 | 0.3163 |
Echinococcus granulosus | bromodomain containing 2 | 0.1252 | 1 | 0.5 |
Toxoplasma gondii | bromodomain-containing protein | 0.0558 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0934332 | 0.313253 | 0.313253 |
Echinococcus multilocularis | bromodomain containing 2 | 0.151883 | 1 | 1 |
Entamoeba histolytica | bromodomain-containing protein | 0.0558 | 0 | 0.5 |
Trichomonas vaginalis | bromodomain containing protein, putative | 0.0777 | 0.3163 | 0.3163 |
Entamoeba histolytica | bromodomain-containing protein | 0.0558 | 0 | 0.5 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.151883 | 1 | 1 |
Onchocerca volvulus | 0.0558 | 0 | 0.5 | |
Trichomonas vaginalis | conserved hypothetical protein | 0.0694 | 0.1964 | 0.1964 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0851118 | 0.215483 | 0.215483 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0777 | 0.3163 | 0.3163 |
Brugia malayi | Bromodomain containing protein | 0.151883 | 1 | 0.5 |
Giardia lamblia | Kinase, putative | 0.0558 | 0 | 0.5 |
Entamoeba histolytica | bromodomain-containing protein | 0.0667717 | 0 | 0.5 |
Onchocerca volvulus | 0.0667717 | 0 | 0.5 | |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0934332 | 0.313253 | 0.313253 |
Trichomonas vaginalis | bromodomain containing protein, putative | 0.0934332 | 0.313253 | 0.313253 |
Entamoeba histolytica | bromodomain-containing protein | 0.0667717 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.1252 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0777 | 0.3163 | 0.3163 |
Brugia malayi | Bromodomain containing protein | 0.1252 | 1 | 0.5 |
Entamoeba histolytica | bromodomain-containing protein | 0.0667717 | 0 | 0.5 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0934332 | 0.313253 | 0.313253 |
Echinococcus granulosus | bromodomain containing 2 | 0.151883 | 1 | 0.5 |
Trichomonas vaginalis | bromodomain-containing protein, putative | 0.0777 | 0.3163 | 0.3163 |
Entamoeba histolytica | bromodomain-containing protein | 0.0558 | 0 | 0.5 |
Giardia lamblia | Kinase, putative | 0.0667717 | 0 | 0.5 |
Schistosoma mansoni | bromodomain-containing protein 3 brd3 | 0.1252 | 1 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (functional) | = 708.29 nM | Antimalarial activity against Plasmodium falciparum D6 | ChEMBL. | 21265542 |
IC50 (functional) | = 1701.59 nM | Antimalarial activity against Plasmodium falciparum W2 | ChEMBL. | 21265542 |
IC50 (functional) | = 2030.86 nM | Antimalarial activity against Plasmodium falciparum C235 | ChEMBL. | 21265542 |
IC90 (functional) | = 1011.31 nM | Antimalarial activity against Plasmodium falciparum D6 | ChEMBL. | 21265542 |
IC90 (functional) | = 3049.06 nM | Antimalarial activity against Plasmodium falciparum C235 | ChEMBL. | 21265542 |
IC90 (functional) | = 3262.4 nM | Antimalarial activity against Plasmodium falciparum W2 | ChEMBL. | 21265542 |
Inhibition (binding) | = 70 % | Inhibition of clostridium botulinum Botulinum neurotoxin type A light chain at 20 uM | ChEMBL. | 21265542 |
Ki (binding) | = 8.1 uM | Inhibition of clostridium botulinum Botulinum neurotoxin type A light chain at 20 uM | ChEMBL. | 21265542 |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Plasmodium falciparum | ChEMBL23 | 21265542 |
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.