Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Mycobacterium tuberculosis | NADH-dependent enoyl-[acyl-carrier-protein] reductase InhA (NADH-dependent enoyl-ACP reductase) | 0.5453 | 1 | 1 |
Echinococcus granulosus | 3 oxoacyl acyl carrier protein reductase | 0.0369 | 0.0424 | 0.5 |
Trypanosoma brucei | oxidoreductase-like protein | 0.0374 | 0.0433 | 1 |
Plasmodium vivax | enoyl-acyl carrier protein reductase | 0.5453 | 1 | 1 |
Echinococcus multilocularis | 3 oxoacyl acyl carrier protein reductase | 0.0369 | 0.0424 | 0.5 |
Leishmania major | pteridine reductase 1 | 0.0374 | 0.0433 | 1 |
Loa Loa (eye worm) | 3-hydroxyacyl-CoA dehydrogenase type II | 0.0369 | 0.0424 | 1 |
Brugia malayi | oxidoreductase, short chain dehydrogenase/reductase family protein | 0.0369 | 0.0424 | 1 |
Mycobacterium tuberculosis | Probable oxidoreductase | 0.0374 | 0.0433 | 0.0009 |
Wolbachia endosymbiont of Brugia malayi | enoyl-ACP reductase | 0.5453 | 1 | 1 |
Schistosoma mansoni | dihydropteridine reductase | 0.0369 | 0.0424 | 0.5 |
Loa Loa (eye worm) | oxidoreductase | 0.0369 | 0.0424 | 1 |
Trypanosoma cruzi | oxidoreductase-like protein, putative | 0.0374 | 0.0433 | 1 |
Leishmania major | oxidoreductase-like protein | 0.0374 | 0.0433 | 1 |
Mycobacterium ulcerans | short-chain type dehydrogenase/reductase | 0.0374 | 0.0433 | 0.0009 |
Toxoplasma gondii | 2,4-dienoyl CoA reductase 2, peroxisomal family protein | 0.0374 | 0.0433 | 0.0009 |
Mycobacterium ulcerans | 3-alpha-hydroxysteroid dehydrogenase | 0.0374 | 0.0433 | 0.0009 |
Onchocerca volvulus | 0.0369 | 0.0424 | 0.9802 | |
Mycobacterium ulcerans | short chain dehydrogenase | 0.0374 | 0.0433 | 0.0009 |
Onchocerca volvulus | 0.0374 | 0.0433 | 1 | |
Trichomonas vaginalis | hypothetical protein | 0.5453 | 1 | 0.5 |
Mycobacterium leprae | NADH-DEPENDENT ENOYL-[ACYL-CARRIER-PROTEIN] REDUCTASE INHA (NADH-DEPENDENT ENOYL-ACP REDUCTASE) | 0.5453 | 1 | 1 |
Mycobacterium ulcerans | short-chain type dehydrogenase/reductase | 0.0374 | 0.0433 | 0.0009 |
Loa Loa (eye worm) | retinol dehydrogenase 12 | 0.0369 | 0.0424 | 1 |
Mycobacterium ulcerans | enoyl-(acyl carrier protein) reductase | 0.5453 | 1 | 1 |
Schistosoma mansoni | 3-oxoacyl-[ACP] reductase | 0.0369 | 0.0424 | 0.5 |
Entamoeba histolytica | 3-oxoacyl-(acyl-carrier protein) reductase, putative | 0.0369 | 0.0424 | 0.5 |
Plasmodium falciparum | enoyl-acyl carrier reductase | 0.5453 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0369 | 0.0424 | 1 |
Brugia malayi | oxidoreductase, short chain dehydrogenase/reductase family protein | 0.0369 | 0.0424 | 1 |
Toxoplasma gondii | enoyl-acyl carrier reductase ENR | 0.5453 | 1 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
GI50 (functional) | -4.803 | PUBCHEM_BIOASSAY: NCI human tumor cell line growth inhibition assay. Data for the HOP-92 Non-Small Cell Lung cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
GI50 (functional) | -4.732 | 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) | -4.588 | 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) | -4.584 | 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) | -4.531 | 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 |
GI50 (functional) | -4.449 | 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) | -4.437 | 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) | -4.429 | 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) | -4.387 | 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) | -4.363 | 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 SN12C Renal cell line. (Class of assay: confirmatory) | ChEMBL. | No reference |
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.