Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | NAD(P)H dehydrogenase, quinone 2 | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Trichomonas vaginalis | NAD(P)H dehydrogenase, putative | NAD(P)H dehydrogenase, quinone 2 | 231 aa | 213 aa | 26.3 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Giardia lamblia | Beta tubulin | 0.0084 | 0.813 | 0.813 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | NAD(P)H dehydrogenase, putative | 0.0096 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Plasmodium vivax | tubulin beta chain, putative | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Giardia lamblia | NADPH oxidoreductase, putative | 0.0096 | 1 | 1 |
Echinococcus multilocularis | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Giardia lamblia | Beta tubulin | 0.0084 | 0.813 | 0.813 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | tubulin beta 4A class IVa | 0.0084 | 0.813 | 1 |
Trypanosoma brucei | beta tubulin | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | BEN-1 protein | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | tubulin beta chain | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | tubulin gamma chain, putative | 0.0084 | 0.813 | 0.813 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Echinococcus granulosus | tubulin beta 1 chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | NAD(P)H dehydrogenase, putative | 0.0096 | 1 | 1 |
Toxoplasma gondii | beta-tubulin, putative | 0.0084 | 0.813 | 1 |
Toxoplasma gondii | beta-1 tubulin, putative | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Loa Loa (eye worm) | beta-tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | beta tubulin | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | tubulin beta-2A chain | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | tubulin beta-1 chain | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | tubulin beta-4 chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | tubulin, putative | 0.0084 | 0.813 | 0.813 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | tubulin epsilon chain, putative | 0.0084 | 0.813 | 0.813 |
Brugia malayi | beta-tubulin, identical | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Entamoeba histolytica | tubulin family protein | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Giardia lamblia | Beta tubulin | 0.0084 | 0.813 | 0.813 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0072 | 0.6208 | 0.6208 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Trypanosoma brucei | beta tubulin | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Giardia lamblia | NADPH oxidoreductase, putative | 0.0096 | 1 | 1 |
Trichomonas vaginalis | tubulin alpha chain, putative | 0.0084 | 0.813 | 0.813 |
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | tubulin epsilon chain, putative | 0.0084 | 0.813 | 0.813 |
Entamoeba histolytica | tubulin family protein | 0.0084 | 0.813 | 1 |
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Toxoplasma gondii | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Echinococcus multilocularis | tubulin beta 1 chain | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | tubulin, beta 4A class IVa | 0.0084 | 0.813 | 1 |
Brugia malayi | Tubulin beta-1 chain | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Trypanosoma brucei | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Loa Loa (eye worm) | BEN-1 protein | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | NAD(P)H dehydrogenase, putative | 0.0096 | 1 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Echinococcus multilocularis | Tubulin beta 2C chain | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | tubulin beta chain, putative | 0.0084 | 0.813 | 0.813 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Plasmodium falciparum | tubulin beta chain | 0.0084 | 0.813 | 1 |
Trypanosoma brucei | beta tubulin | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Schistosoma mansoni | tubulin subunit beta | 0.0084 | 0.813 | 1 |
Leishmania major | beta tubulin | 0.0084 | 0.813 | 1 |
Trypanosoma cruzi | beta tubulin, putative | 0.0084 | 0.813 | 1 |
Echinococcus granulosus | beta tubulin | 0.0084 | 0.813 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0096 | 1 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Activity (ADMET) | = 101.7 % | Cytotoxicity against human UACC62 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 102.78 % | Cytotoxicity against human SN12C cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 105.75 % | Cytotoxicity against human MCF7 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 106.32 % | Cytotoxicity against human OVCAR3 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 108.11 % | Cytotoxicity against human DU145 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 108.2 % | Cytotoxicity against human HCT116 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 108.99 % | Cytotoxicity against human HOP62 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
Activity (ADMET) | = 117.31 % | Cytotoxicity against human SF539 cells assessed as cell growth at 10 uM | ChEMBL. | 22206487 |
IC50 (binding) | = 3.3 uM | Inhibition of human quinone reductase 2 using NMeH as substrate by MTT assay | ChEMBL. | 22206487 |
Imax (binding) | = 87.9 % | Inhibition of human quinone reductase 2 using NMeH as substrate by MTT assay relative to control | ChEMBL. | 22206487 |
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.