Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Mycobacterium tuberculosis | Probable oxidoreductase | 0.0393 | 1 | 0.5 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Echinococcus granulosus | aldo keto reductase | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase | 0.0393 | 1 | 1 |
Trichomonas vaginalis | aldo/keto reductase, putative | 0.0393 | 1 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Trichomonas vaginalis | dihydrodiol dehydrogenase, putative | 0.0393 | 1 | 0.5 |
Schistosoma mansoni | pol-related | 0.0393 | 1 | 0.5 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Trypanosoma brucei | prostaglandin f synthase | 0.0393 | 1 | 0.5 |
Trypanosoma brucei | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Brugia malayi | oxidoreductase, aldo/keto reductase family protein | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase | 0.0393 | 1 | 1 |
Loa Loa (eye worm) | oxidoreductase | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo/keto reductase, putative | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | dihydrodiol dehydrogenase, putative | 0.0393 | 1 | 0.5 |
Leishmania major | prostaglandin f2-alpha synthase/D-arabinose dehydrogenase | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Brugia malayi | oxidoreductase, aldo/keto reductase family protein | 0.0393 | 1 | 0.5 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Trichomonas vaginalis | dihydrodiol dehydrogenase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Loa Loa (eye worm) | oxidoreductase | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Leishmania major | prostaglandin f synthase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Brugia malayi | oxidoreductase, aldo/keto reductase family protein | 0.0393 | 1 | 0.5 |
Leishmania major | aldo-keto reductase-like protein | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | hypothetical protein | 0.0393 | 1 | 1 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Loa Loa (eye worm) | oxidoreductase | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Loa Loa (eye worm) | oxidoreductase | 0.0393 | 1 | 0.5 |
Trypanosoma cruzi | aldo/keto reductase, putative | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo/keto reductase, putative | 0.0393 | 1 | 0.5 |
Schistosoma mansoni | aldo-keto reductase | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Echinococcus granulosus | aldo keto reductase | 0.0393 | 1 | 1 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Entamoeba histolytica | aldose reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus multilocularis | aldo keto reductase | 0.0393 | 1 | 1 |
Echinococcus granulosus | aldo keto reductase | 0.0393 | 1 | 1 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase | 0.0393 | 1 | 1 |
Trypanosoma cruzi | aldo-keto reductase | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Leishmania major | aldehyde reductase, putative,oxidoreductase, putative | 0.0393 | 1 | 0.5 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Mycobacterium leprae | PROBABLE OXIDOREDUCTASE | 0.0393 | 1 | 1 |
Onchocerca volvulus | 0.0393 | 1 | 0.5 | |
Giardia lamblia | Aldose reductase | 0.0393 | 1 | 0.5 |
Toxoplasma gondii | aldose reductase, putative | 0.0393 | 1 | 0.5 |
Entamoeba histolytica | aldose reductase, putative | 0.0393 | 1 | 0.5 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Trichomonas vaginalis | aldo-keto reductase, putative | 0.0393 | 1 | 0.5 |
Loa Loa (eye worm) | oxidoreductase | 0.0393 | 1 | 0.5 |
Schistosoma mansoni | aldo-keto reductase | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Echinococcus multilocularis | aldo keto reductase family 1, member B4 | 0.0393 | 1 | 1 |
Mycobacterium ulcerans | oxidoreductase | 0.0393 | 1 | 0.5 |
Echinococcus granulosus | aldo keto reductase family 1 member B4 | 0.0393 | 1 | 1 |
Entamoeba histolytica | aldose reductase, putative | 0.0393 | 1 | 0.5 |
Giardia lamblia | Aldose reductase | 0.0393 | 1 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
C1.6 (functional) | = 0.48 mM | Average intracellular compound concentration when the hypoxic SER=1.6. | ChEMBL. | 8308864 |
C1.6 (functional) | = 0.93 mM | Compound concentration at which sensitizer enhancement ratio =1.6 under hypoxia. | ChEMBL. | 8308864 |
CT10 (ADMET) | = 6 mM-hr | Compound concentration required to reduce cell survival to 10% of control values under hypoxic condition | ChEMBL. | 8308864 |
GI50 (functional) | -5 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the DU-145 Prostate cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MDA-N Breast cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SN12C Renal cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the NCI-H23 Non-Small Cell Lung cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the UO-31 Renal cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the ACHN Renal cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HL-60(TB) Leukemia cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SF-539 Central Nervous System cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the SK-MEL-5 Melanoma cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the MALME-3M Melanoma cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
Hypersensitivity factor (functional) | = 1.2 | Aerobic cytotoxicity of the compound against UV4 cells in a growth inhibition microassay | ChEMBL. | 8308864 |
Hypersensitivity factor (functional) | = 1.7 | Aerobic cytotoxicity of the compound against murine mammary carcinoma EMT6 cells in a growth inhibition microassay | ChEMBL. | 8308864 |
Hypersensitivity factor (functional) | = 3.5 | Aerobic cytotoxicity of the compound against human melanoma FME cells in a growth inhibition microassay | ChEMBL. | 8308864 |
IC50 (functional) | = 3.8 mM | Concentration of the compound required to reduce AA8 cell numbers to 50% of controls in a growth inhibition microassay | ChEMBL. | 8308864 |
logP (ADMET) | = -0.79 | Partition coefficient (logP) | ChEMBL. | 8308864 |
Ratio (functional) | > 7 | The ratio of aerobic CT10 to hypoxic CT10. | ChEMBL. | 8308864 |
Solubility | = 8.6 | Solubility in mMol was measured by UV spectrophotometry. | ChEMBL. | 8308864 |
TI (ADMET) | = 4 | Invitro therapeutic index of the compound (aerobic IC50 / hypoxic C1.6) | ChEMBL. | 8308864 |
Uptake ratio (functional) | = 0.52 | Ratio of mean intracellular to extracellular compound concentration determined under hypoxic condition. | ChEMBL. | 8308864 |
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.