Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | sodium channel, voltage-gated, type IX, alpha subunit | Starlite/ChEMBL | References |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | thymidylate kinase | 0.0224 | 0.0375 | 0.0396 |
Mycobacterium ulcerans | thymidylate synthase | 0.4359 | 0.9458 | 1 |
Trypanosoma cruzi | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0363 |
Loa Loa (eye worm) | dihydrofolate reductase | 0.0464 | 0.0902 | 0.0954 |
Leishmania major | deoxyuridine triphosphatase, putative,dUTP diphosphatase | 0.0367 | 0.069 | 0.0618 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase, putative | 0.2074 | 0.4439 | 0.4396 |
Schistosoma mansoni | hypothetical protein | 0.0216 | 0.0359 | 0.0379 |
Echinococcus granulosus | dihydrofolate reductase | 0.0464 | 0.0902 | 0.0954 |
Brugia malayi | thymidylate kinase | 0.0224 | 0.0375 | 0.0394 |
Brugia malayi | Dihydrofolate reductase | 0.0464 | 0.0902 | 0.0952 |
Chlamydia trachomatis | dihydrofolate reductase | 0.0464 | 0.0902 | 1 |
Brugia malayi | Immunoglobulin I-set domain containing protein | 0.0097 | 0.0097 | 0.0101 |
Schistosoma mansoni | hypothetical protein | 0.0076 | 0.0051 | 0.0054 |
Loa Loa (eye worm) | immunoglobulin I-set domain-containing protein | 0.0097 | 0.0097 | 0.0103 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase | 0.4605 | 1 | 1 |
Schistosoma mansoni | dihydrofolate reductase | 0.0464 | 0.0902 | 0.0954 |
Trypanosoma cruzi | deoxyuridine triphosphatase, putative | 0.0367 | 0.069 | 0.0618 |
Echinococcus multilocularis | dihydrofolate reductase | 0.0464 | 0.0902 | 0.0954 |
Trypanosoma cruzi | thymidylate kinase, putative | 0.0224 | 0.0375 | 0.0301 |
Loa Loa (eye worm) | thymidylate synthase | 0.4359 | 0.9458 | 1 |
Leishmania major | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0363 |
Plasmodium vivax | bifunctional dihydrofolate reductase-thymidylate synthase, putative | 0.4605 | 1 | 1 |
Schistosoma mansoni | thymidylate kinase | 0.0224 | 0.0375 | 0.0396 |
Echinococcus multilocularis | thymidylate synthase | 0.4359 | 0.9458 | 1 |
Plasmodium falciparum | bifunctional dihydrofolate reductase-thymidylate synthase | 0.4605 | 1 | 1 |
Trypanosoma brucei | thymidine kinase | 0.0252 | 0.0437 | 0.0081 |
Schistosoma mansoni | thymidylate kinase | 0.0224 | 0.0375 | 0.0396 |
Brugia malayi | C2-HC type zinc finger protein C.e-MyT1 | 0.011 | 0.0126 | 0.0131 |
Mycobacterium tuberculosis | Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) | 0.0464 | 0.0902 | 0.0581 |
Trichomonas vaginalis | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0153 |
Leishmania major | thymidylate kinase-like protein | 0.0224 | 0.0375 | 0.0301 |
Brugia malayi | hypothetical protein | 0.2074 | 0.4439 | 0.4692 |
Onchocerca volvulus | 0.4359 | 0.9458 | 1 | |
Loa Loa (eye worm) | immunoglobulin I-set domain-containing protein | 0.0097 | 0.0097 | 0.0103 |
Mycobacterium ulcerans | dihydrofolate reductase DfrA | 0.0464 | 0.0902 | 0.0581 |
Brugia malayi | thymidylate synthase | 0.4359 | 0.9458 | 1 |
Echinococcus granulosus | thymidylate kinase | 0.0224 | 0.0375 | 0.0396 |
Brugia malayi | Immunoglobulin I-set domain containing protein | 0.0097 | 0.0097 | 0.0101 |
Trypanosoma brucei | thymidylate kinase, putative | 0.0224 | 0.0375 | 0.0017 |
Wolbachia endosymbiont of Brugia malayi | thymidylate kinase | 0.0224 | 0.0375 | 0.5 |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | 0.4605 | 1 | 1 |
Trypanosoma cruzi | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0363 |
Trypanosoma cruzi | thymidylate kinase, putative | 0.0224 | 0.0375 | 0.0301 |
Mycobacterium leprae | DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) | 0.0464 | 0.0902 | 0.0581 |
Echinococcus multilocularis | nephrin | 0.0076 | 0.0051 | 0.0054 |
Trypanosoma brucei | deoxyuridine triphosphatase, putative | 0.0367 | 0.069 | 0.0343 |
Echinococcus granulosus | thymidylate synthase | 0.4359 | 0.9458 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0224 | 0.0375 | 0.0396 |
Giardia lamblia | Thymidine kinase | 0.0252 | 0.0437 | 1 |
Echinococcus multilocularis | suppression of tumorigenicity 18 protein | 0.011 | 0.0126 | 0.0133 |
Echinococcus granulosus | nephrin | 0.0076 | 0.0051 | 0.0054 |
Trichomonas vaginalis | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0153 |
Brugia malayi | dihydrofolate reductase family protein | 0.0464 | 0.0902 | 0.0952 |
Echinococcus granulosus | nephrin | 0.0076 | 0.0051 | 0.0054 |
Trypanosoma cruzi | deoxyuridine triphosphatase, putative | 0.0367 | 0.069 | 0.0618 |
Echinococcus granulosus | irregular chiasm roughest protein | 0.0076 | 0.0051 | 0.0054 |
Echinococcus granulosus | Immunoglobulin | 0.0076 | 0.0051 | 0.0054 |
Echinococcus granulosus | suppression of tumorigenicity 18 protein | 0.011 | 0.0126 | 0.0133 |
Loa Loa (eye worm) | hypothetical protein | 0.0054 | 0.0002 | 0.0002 |
Trypanosoma brucei | dihydrofolate reductase-thymidylate synthase | 0.4605 | 1 | 1 |
Mycobacterium tuberculosis | Hypothetical protein | 0.2074 | 0.4439 | 0.4474 |
Mycobacterium leprae | PROBABLE THYMIDYLATE SYNTHASE THYA (TS) (TSASE) | 0.4359 | 0.9458 | 1 |
Treponema pallidum | thymidylate kinase (tmk) | 0.0224 | 0.0375 | 0.5 |
Schistosoma mansoni | bifunctional dihydrofolate reductase-thymidylate synthase | 0.4359 | 0.9458 | 1 |
Echinococcus multilocularis | thymidylate kinase | 0.0224 | 0.0375 | 0.0396 |
Trichomonas vaginalis | conserved hypothetical protein | 0.2074 | 0.4439 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0076 | 0.0051 | 0.0054 |
Echinococcus multilocularis | irregular chiasm roughest protein immunoglobulin set domain containing protein | 0.0076 | 0.0051 | 0.0054 |
Trichomonas vaginalis | thymidine kinase, putative | 0.0252 | 0.0437 | 0.0153 |
Mycobacterium tuberculosis | Probable thymidylate synthase ThyA (ts) (TSASE) | 0.4359 | 0.9458 | 1 |
Echinococcus multilocularis | Immunoglobulin | 0.0076 | 0.0051 | 0.0054 |
Entamoeba histolytica | thymidine kinase, putative | 0.0252 | 0.0437 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.011 | 0.0126 | 0.0133 |
Brugia malayi | hypothetical protein | 0.0097 | 0.0097 | 0.0101 |
Echinococcus multilocularis | conserved hypothetical protein | 0.0076 | 0.0051 | 0.0054 |
Trypanosoma brucei | thymidylate kinase, putative | 0.0224 | 0.0375 | 0.0017 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
AUC (ADMET) | = 0.08 uM.hr.Kg/mg | Normalized AUC in Sprague-Dawley rat at 3.0 mg/kg, po | ChEMBL. | 18243692 |
CL (ADMET) | = 64 ml/min.kg | Plasma clearance in Sprague-Dawley rat at 1.0 mg/kg, iv or 3.0 mg/kg, po | ChEMBL. | 18243692 |
F (ADMET) | = 17 % | Bioavailability in Sprague-Dawley rat at 3.0 mg/kg, po | ChEMBL. | 18243692 |
IC50 (binding) | = 83 nM | Blockade of human Nav1.7 channel expressed in HEK293 cells by FRET assay | ChEMBL. | 18243692 |
IC50 (binding) | = 83 nM | Blockade of human Nav1.7 channel expressed in HEK293 cells by FRET assay | ChEMBL. | 18243692 |
Inhibition (binding) | = 19 % | Displacement of MK499 from human ERG channel at 10 uM | ChEMBL. | 18243692 |
Inhibition (binding) | = 19 % | Displacement of MK499 from human ERG channel at 10 uM | ChEMBL. | 18243692 |
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.