Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | Curated by TDR Targets | References |
Homo sapiens | cytochrome P450, family 2, subfamily D, polypeptide 6 | Starlite/ChEMBL | References |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 9 | Starlite/ChEMBL | References |
Homo sapiens | cytochrome P450, family 1, subfamily A, polypeptide 2 | Starlite/ChEMBL | References |
Homo sapiens | cytochrome P450, family 2, subfamily C, polypeptide 19 | Starlite/ChEMBL | References |
Homo sapiens | cytochrome P450, family 3, subfamily A, polypeptide 4 | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | cytochrome P450 | cytochrome P450, family 3, subfamily A, polypeptide 4 | 502 aa | 492 aa | 24.2 % |
Brugia malayi | cytochrome P450 | cytochrome P450, family 2, subfamily D, polypeptide 6 | 497 aa | 425 aa | 32.0 % |
Mycobacterium tuberculosis | Probable cytochrome P450 136 Cyp136 | cytochrome P450, family 2, subfamily C, polypeptide 9 | 490 aa | 441 aa | 21.8 % |
Brugia malayi | Cytochrome P450 family protein | cytochrome P450, family 1, subfamily A, polypeptide 2 | 516 aa | 470 aa | 26.2 % |
Leishmania major | cytochrome p450-like protein | cytochrome P450, family 2, subfamily C, polypeptide 19 | 490 aa | 411 aa | 23.1 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Mycobacterium leprae | PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) | 0.013 | 0.5922 | 1 |
Brugia malayi | thymidylate synthase | 0.013 | 0.5922 | 1 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase | 0.0183 | 1 | 1 |
Brugia malayi | Cytochrome P450 family protein | 0.0067 | 0.1121 | 0.1892 |
Loa Loa (eye worm) | thymidylate synthase | 0.013 | 0.5922 | 1 |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0183 | 1 | 0.5 |
Mycobacterium tuberculosis | Hypothetical protein | 0.0062 | 0.068 | 0.1148 |
Plasmodium vivax | bifunctional dihydrofolate reductase-thymidylate synthase, putative | 0.0183 | 1 | 0.5 |
Brugia malayi | hypothetical protein | 0.0062 | 0.068 | 0.1148 |
Plasmodium falciparum | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0183 | 1 | 0.5 |
Echinococcus multilocularis | thymidylate synthase | 0.013 | 0.5922 | 1 |
Onchocerca volvulus | 0.013 | 0.5922 | 0.5 | |
Echinococcus granulosus | thymidylate synthase | 0.013 | 0.5922 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0062 | 0.068 | 0.5 |
Chlamydia trachomatis | dihydrofolate reductase | 0.0053 | 0 | 0.5 |
Schistosoma mansoni | bifunctional dihydrofolate reductase-thymidylate synthase | 0.013 | 0.5922 | 1 |
Trypanosoma brucei | dihydrofolate reductase-thymidylate synthase | 0.0183 | 1 | 0.5 |
Mycobacterium tuberculosis | Probable thymidylate synthase ThyA (ts) (TSASE) | 0.013 | 0.5922 | 1 |
Loa Loa (eye worm) | cytochrome P450 family protein | 0.0067 | 0.1121 | 0.1892 |
Mycobacterium ulcerans | thymidylate synthase | 0.013 | 0.5922 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 1.1 nM | Inhibition of 20-HETE synthesis in human renal microsomes | ChEMBL. | 14698153 |
IC50 (ADMET) | < 46 nM | Inhibition of cytochrome P450 1A2 | ChEMBL. | 14698153 |
IC50 (ADMET) | < 46 nM | Inhibition of cytochrome P450 2C19 | ChEMBL. | 14698153 |
IC50 (ADMET) | < 46 nM | Inhibition of cytochrome P450 1A2 | ChEMBL. | 14698153 |
IC50 (ADMET) | < 46 nM | Inhibition of cytochrome P450 2C19 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 185 nM | Inhibition of cytochrome P450 2C9 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 185 nM | Inhibition of cytochrome P450 2C9 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 417 nM | Inhibition of cytochrome P450 3A4 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 417 nM | Inhibition of cytochrome P450 3A4 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 1300 nM | Inhibition of cytochrome P450 2D6 | ChEMBL. | 14698153 |
IC50 (ADMET) | = 1300 nM | Inhibition of cytochrome P450 2D6 | ChEMBL. | 14698153 |
logD | = 2.85 | Distribution coefficient of compound was evaluated at pH 6.8 | ChEMBL. | 14698153 |
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.