Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | hexokinase type II | 0.0189 | 0.3527 | 0.3527 |
Echinococcus granulosus | choline O acetyltransferase | 0.0164 | 0.2785 | 0.2785 |
Trypanosoma brucei | hexokinase | 0.0189 | 0.3527 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0129 | 0.1759 | 0.1759 |
Brugia malayi | Hexokinase family protein | 0.0189 | 0.3527 | 0.3527 |
Brugia malayi | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Echinococcus multilocularis | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Plasmodium falciparum | hexokinase | 0.0189 | 0.3527 | 1 |
Loa Loa (eye worm) | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Treponema pallidum | hexokinase (hxk) | 0.0189 | 0.3527 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.041 | 1 | 1 |
Onchocerca volvulus | 0.0189 | 0.3527 | 1 | |
Echinococcus multilocularis | choline O acetyltransferase | 0.0164 | 0.2785 | 0.2785 |
Echinococcus granulosus | hexokinase type 2 | 0.0189 | 0.3527 | 0.3527 |
Echinococcus granulosus | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Plasmodium vivax | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Trypanosoma brucei | hexokinase | 0.0189 | 0.3527 | 1 |
Trichomonas vaginalis | spcc417.12 protein, putative | 0.0069 | 0 | 0.5 |
Trypanosoma cruzi | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Trichomonas vaginalis | carboxylesterase domain containing protein, putative | 0.0069 | 0 | 0.5 |
Brugia malayi | Hexokinase family protein | 0.0119 | 0.1455 | 0.1455 |
Entamoeba histolytica | hexokinase 1 | 0.0189 | 0.3527 | 0.5 |
Trypanosoma brucei | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Mycobacterium tuberculosis | Carboxylesterase LipT | 0.0069 | 0 | 0.5 |
Toxoplasma gondii | hexokinase | 0.0189 | 0.3527 | 1 |
Echinococcus multilocularis | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.2785 | 0.2785 |
Entamoeba histolytica | hexokinase 2 | 0.0189 | 0.3527 | 0.5 |
Echinococcus multilocularis | hexokinase type 2 | 0.0189 | 0.3527 | 0.3527 |
Echinococcus multilocularis | carboxylesterase 5A | 0.041 | 1 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.041 | 1 | 1 |
Trypanosoma cruzi | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Brugia malayi | Choline O-acetyltransferase | 0.0164 | 0.2785 | 0.2785 |
Schistosoma mansoni | choline o-acyltransferase | 0.0164 | 0.2785 | 0.2785 |
Echinococcus granulosus | carboxylesterase 5A | 0.041 | 1 | 1 |
Leishmania major | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Onchocerca volvulus | 0.0119 | 0.1455 | 0.4126 | |
Mycobacterium ulcerans | carboxylesterase, LipT | 0.0069 | 0 | 0.5 |
Brugia malayi | Choline O-acetyltransferase | 0.0164 | 0.2785 | 0.2785 |
Onchocerca volvulus | 0.0189 | 0.3527 | 1 | |
Leishmania major | hexokinase, putative | 0.0189 | 0.3527 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.041 | 1 | 1 |
Onchocerca volvulus | 0.0189 | 0.3527 | 1 | |
Echinococcus multilocularis | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Schistosoma mansoni | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.041 | 1 | 1 |
Loa Loa (eye worm) | carboxylesterase | 0.041 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.041 | 1 | 1 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.041 | 1 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.041 | 1 | 1 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0069 | 0 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.041 | 1 | 1 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0069 | 0 | 0.5 |
Loa Loa (eye worm) | choline O-acetyltransferase | 0.0164 | 0.2785 | 0.2785 |
Onchocerca volvulus | Hexokinase homolog | 0.0119 | 0.1455 | 0.4126 |
Loa Loa (eye worm) | hypothetical protein | 0.041 | 1 | 1 |
Echinococcus granulosus | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Loa Loa (eye worm) | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Loa Loa (eye worm) | hexokinase | 0.0119 | 0.1455 | 0.1455 |
Echinococcus granulosus | hexokinase | 0.0189 | 0.3527 | 0.3527 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (functional) | = 8 uM | Cytotoxicity towards BE-NQ (NQO1-rich) human colon adenocarcinoma cell line | ChEMBL. | 16302813 |
IC50 (functional) | = 8 uM | Cytotoxicity towards BE-NQ (NQO1-rich) human colon adenocarcinoma cell line | ChEMBL. | 16302813 |
IC50 (functional) | = 16.8 uM | Cytotoxicity towards BE-WT (NQO1-deficient) human colon adenocarcinoma cell line | ChEMBL. | 16302813 |
IC50 (functional) | = 16.8 uM | Cytotoxicity towards BE-WT (NQO1-deficient) human colon adenocarcinoma cell line | ChEMBL. | 16302813 |
MET (ADMET) | = 24 umol/min/mg | Metabolism by recombinant human NQO1 monitored by spectrophotometric cytochrome assay | ChEMBL. | 16302813 |
MET (ADMET) | = 24 umol/min/mg | Metabolism by recombinant human NQO1 monitored by spectrophotometric cytochrome assay | ChEMBL. | 16302813 |
MTD (ADMET) | = 400 mg kg-1 | Toxicity in mouse | ChEMBL. | 17035024 |
Ratio IC50 (functional) | = 2.1 | Selectivity for BE-WT cell line over the BE-NQ cell line | ChEMBL. | 16302813 |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Homo sapiens | ChEMBL23 | 16302813 |
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.