Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | thymidylate synthetase | Starlite/ChEMBL | References |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | Starlite/ChEMBL | References |
Escherichia coli | Dihydrofolate reductase | Starlite/ChEMBL | References |
Pneumocystis carinii | Dihydrofolate reductase | References | |
Rattus norvegicus | Dihydrofolate reductase | Starlite/ChEMBL | References |
Escherichia coli | thymidylate synthetase | Starlite/ChEMBL | References |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trichomonas vaginalis | conserved hypothetical protein | 0.0247 | 0.1894 | 1 |
Giardia lamblia | Histone deacetylase | 0.0123 | 0.0114 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.0703 | 0.113 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.0703 | 0.113 |
Chlamydia trachomatis | dihydrofolate reductase | 0.0547 | 0.622 | 0.5 |
Brugia malayi | Matrixin family protein | 0.0164 | 0.0703 | 0.113 |
Plasmodium vivax | bifunctional dihydrofolate reductase-thymidylate synthase, putative | 0.081 | 1 | 1 |
Brugia malayi | Matrixin family protein | 0.0397 | 0.4053 | 0.6516 |
Mycobacterium leprae | DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) | 0.0547 | 0.622 | 1 |
Echinococcus multilocularis | dihydrofolate reductase | 0.0547 | 0.622 | 0.8957 |
Brugia malayi | thymidylate synthase | 0.0519 | 0.5811 | 0.9343 |
Brugia malayi | dihydrofolate reductase family protein | 0.0547 | 0.622 | 1 |
Mycobacterium tuberculosis | Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) | 0.0547 | 0.622 | 1 |
Brugia malayi | hypothetical protein | 0.0247 | 0.1894 | 0.3045 |
Loa Loa (eye worm) | matrix metalloproteinase | 0.0164 | 0.0703 | 0.113 |
Loa Loa (eye worm) | hypothetical protein | 0.0123 | 0.0114 | 0.0184 |
Entamoeba histolytica | histone deacetylase, putative | 0.0123 | 0.0114 | 0.5 |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | 0.081 | 1 | 1 |
Echinococcus granulosus | dihydrofolate reductase | 0.0547 | 0.622 | 0.8957 |
Brugia malayi | Histone deacetylase 1 | 0.0123 | 0.0114 | 0.0184 |
Schistosoma mansoni | hypothetical protein | 0.0233 | 0.169 | 0.2581 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase | 0.081 | 1 | 1 |
Echinococcus granulosus | matrix metallopeptidase 7 M10 family | 0.0597 | 0.6931 | 1 |
Echinococcus multilocularis | matrix metallopeptidase 7 (M10 family) | 0.0597 | 0.6931 | 1 |
Brugia malayi | Dihydrofolate reductase | 0.0547 | 0.622 | 1 |
Brugia malayi | Matrixin family protein | 0.0164 | 0.0703 | 0.113 |
Brugia malayi | Hemopexin family protein | 0.0233 | 0.169 | 0.2717 |
Brugia malayi | histone deacetylase 3 (HD3) | 0.0123 | 0.0114 | 0.0184 |
Mycobacterium tuberculosis | Probable thymidylate synthase ThyA (ts) (TSASE) | 0.0519 | 0.5811 | 0.9183 |
Trypanosoma brucei | dihydrofolate reductase-thymidylate synthase | 0.081 | 1 | 1 |
Loa Loa (eye worm) | thymidylate synthase | 0.0519 | 0.5811 | 0.9343 |
Brugia malayi | Matrixin family protein | 0.0164 | 0.0703 | 0.113 |
Mycobacterium leprae | PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) | 0.0519 | 0.5811 | 0.9183 |
Mycobacterium tuberculosis | Hypothetical protein | 0.0247 | 0.1894 | 0.1352 |
Loa Loa (eye worm) | dihydrofolate reductase | 0.0547 | 0.622 | 1 |
Onchocerca volvulus | Matrilysin homolog | 0.0364 | 0.3581 | 0.5634 |
Loa Loa (eye worm) | matrixin family protein | 0.0364 | 0.3581 | 0.5757 |
Brugia malayi | Matrixin family protein | 0.0164 | 0.0703 | 0.113 |
Loa Loa (eye worm) | histone deacetylase 1 | 0.0123 | 0.0114 | 0.0184 |
Onchocerca volvulus | 0.0233 | 0.169 | 0.1933 | |
Brugia malayi | Matrix metalloprotease, N-terminal domain containing protein | 0.02 | 0.1218 | 0.1958 |
Loa Loa (eye worm) | matrixin family protein | 0.0397 | 0.4053 | 0.6516 |
Mycobacterium ulcerans | thymidylate synthase | 0.0519 | 0.5811 | 0.9183 |
Loa Loa (eye worm) | hypothetical protein | 0.02 | 0.1218 | 0.1958 |
Schistosoma mansoni | matrix metallopeptidase-7 (M10 family) | 0.0164 | 0.0703 | 0.0964 |
Plasmodium falciparum | bifunctional dihydrofolate reductase-thymidylate synthase | 0.081 | 1 | 1 |
Mycobacterium ulcerans | dihydrofolate reductase DfrA | 0.0547 | 0.622 | 1 |
Schistosoma mansoni | dihydrofolate reductase | 0.0547 | 0.622 | 1 |
Onchocerca volvulus | 0.0519 | 0.5811 | 1 | |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.0703 | 0.113 |
Echinococcus granulosus | thymidylate synthase | 0.0519 | 0.5811 | 0.8357 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase, putative | 0.0247 | 0.1894 | 0.18 |
Schistosoma mansoni | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0519 | 0.5811 | 0.9331 |
Echinococcus multilocularis | thymidylate synthase | 0.0519 | 0.5811 | 0.8357 |
Loa Loa (eye worm) | histone deacetylase 3 | 0.0123 | 0.0114 | 0.0184 |
Brugia malayi | histone deacetylase 1 (HD1) | 0.0123 | 0.0114 | 0.0184 |
Onchocerca volvulus | Matrix metalloproteinase homolog | 0.0364 | 0.3581 | 0.5634 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 1.4 uM | Inhibition of Escherichia coli dihydrofolate reductase | ChEMBL. | 18605720 |
IC50 (binding) | = 1.4 uM | Inhibition of Toxoplasma gondii dihydrofolate reductase | ChEMBL. | 18605720 |
IC50 (binding) | = 8.9 uM | Inhibition of rat liver DHFR using dihydrofolic acid substrate and NADPH cofactor | ChEMBL. | 18605720 |
IC50 (binding) | = 10.4 uM | Inhibition of Pneumocystis carinii DHFR using dihydrofolic acid substrate and NADPH cofactor | ChEMBL. | 18605720 |
IC50 (binding) | > 12 uM | Inhibition of human thymidylate synthase | ChEMBL. | 18605720 |
IC50 (binding) | > 12 uM | Inhibition of Escherichia coli thymidylate synthase | ChEMBL. | 18605720 |
IC50 (binding) | > 12 uM | Inhibition of Toxoplasma gondii thymidylate synthase | ChEMBL. | 18605720 |
IC50 (binding) | = 28 uM | Inhibition of human dihydrofolate reductase | ChEMBL. | 18605720 |
Inhibition (binding) | = 0 % | Inhibition of human thymidylate synthase at >12 uM | ChEMBL. | 18605720 |
Inhibition (binding) | = 0 % | Inhibition of Escherichia coli thymidylate synthase at >12 uM | ChEMBL. | 18605720 |
Inhibition (binding) | = 0 % | Inhibition of Toxoplasma gondii thymidylate synthase at >12 uM | ChEMBL. | 18605720 |
Inhibition (binding) | = 13 % | Inhibition of human dihydrofolate reductase at >28 uM | ChEMBL. | 18605720 |
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.