Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | potassium voltage-gated channel, subfamily H (eag-related), member 2 | Starlite/ChEMBL | References |
Homo sapiens | solute carrier family 6 (neurotransmitter transporter), member 2 | Starlite/ChEMBL | References |
Homo sapiens | solute carrier family 6 (neurotransmitter transporter), member 3 | Starlite/ChEMBL | References |
Homo sapiens | solute carrier family 6 (neurotransmitter transporter), member 4 | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Sodium:neurotransmitter symporter family protein | solute carrier family 6 (neurotransmitter transporter), member 4 | 630 aa | 574 aa | 31.5 % |
Brugia malayi | Sodium:neurotransmitter symporter family protein | solute carrier family 6 (neurotransmitter transporter), member 2 | 617 aa | 638 aa | 32.5 % |
Brugia malayi | Sodium:neurotransmitter symporter family protein | solute carrier family 6 (neurotransmitter transporter), member 3 | 620 aa | 579 aa | 33.2 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | voltage and ligand gated potassium channel | 0.0045 | 0.0109 | 0.0109 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | serotonin transporter b | 0.0292 | 0.4716 | 0.4716 |
Echinococcus granulosus | dihydrofolate reductase | 0.0576 | 1 | 1 |
Mycobacterium tuberculosis | Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium-dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Brugia malayi | hypothetical protein | 0.0053 | 0.026 | 0.0152 |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Brugia malayi | Sodium:neurotransmitter symporter family protein 1, putative | 0.005 | 0.0203 | 0.0095 |
Mycobacterium tuberculosis | Probable thymidylate synthase ThyA (ts) (TSASE) | 0.0111 | 0.1339 | 0.1108 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0053 | 0.026 | 1 |
Plasmodium vivax | bifunctional dihydrofolate reductase-thymidylate synthase, putative | 0.0359 | 0.5956 | 1 |
Echinococcus granulosus | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | thymidylate synthase | 0.0111 | 0.1339 | 0.1339 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.005 | 0.0203 | 0.0018 |
Echinococcus granulosus | uncharacterized sodium dependent transporter | 0.005 | 0.0203 | 0.0095 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0203 |
Echinococcus multilocularis | sodium dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0095 |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Echinococcus multilocularis | sodium:chloride dependent neurotransmitter | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | solute carrier family 6 member 4 | 0.0292 | 0.4716 | 0.4716 |
Echinococcus granulosus | sodium dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0095 |
Echinococcus granulosus | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Echinococcus multilocularis | dihydrofolate reductase | 0.0576 | 1 | 1 |
Loa Loa (eye worm) | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0203 |
Echinococcus multilocularis | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.0292 | 0.4716 | 0.4657 |
Echinococcus granulosus | sodium:chloride dependent neurotransmitter | 0.005 | 0.0203 | 0.0095 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.0292 | 0.4716 | 0.4616 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Schistosoma mansoni | sodium-dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Schistosoma mansoni | sodium/chloride dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Echinococcus multilocularis | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Brugia malayi | hypothetical protein | 0.005 | 0.0203 | 0.0095 |
Echinococcus granulosus | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Leishmania major | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 0.5 |
Schistosoma mansoni | dihydrofolate reductase | 0.0576 | 1 | 1 |
Brugia malayi | Dihydrofolate reductase | 0.0576 | 1 | 1 |
Mycobacterium ulcerans | dihydrofolate reductase DfrA | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Trypanosoma brucei | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 0.5 |
Chlamydia trachomatis | dihydrofolate reductase | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium-dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Schistosoma mansoni | sodium/chloride dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Treponema pallidum | sodium- and chloride- dependent transporter | 0.0292 | 0.4716 | 0.5 |
Schistosoma mansoni | sodium/chloride dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | norepinephrine transporter | 0.0292 | 0.4716 | 0.4716 |
Schistosoma mansoni | sodium-dependent amino acid transporter | 0.005 | 0.0203 | 0.0018 |
Echinococcus multilocularis | uncharacterized sodium dependent transporter | 0.005 | 0.0203 | 0.0095 |
Plasmodium falciparum | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Schistosoma mansoni | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0111 | 0.1339 | 0.1175 |
Onchocerca volvulus | 0.0292 | 0.4716 | 1 | |
Onchocerca volvulus | 0.0111 | 0.1339 | 0.2518 | |
Echinococcus multilocularis | serotonin transporter | 0.0292 | 0.4716 | 0.4657 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0095 |
Echinococcus granulosus | uncharacterized sodium dependent transporter | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | dihydrofolate reductase | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.0292 | 0.4716 | 0.4616 |
Brugia malayi | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Echinococcus multilocularis | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Mycobacterium leprae | DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) | 0.0576 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Echinococcus granulosus | serotonin transporter | 0.0292 | 0.4716 | 0.4657 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.005 | 0.0203 | 0.0018 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
CL (ADMET) | = 9 microL/min/mg | Metabolic stability assessed as intrinsic clearance in human liver microsomes | ChEMBL. | 18240382 |
IC50 (binding) | = 13 nM | Inhibition of [3H]5HT uptake at human 5HT transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 13 nM | Inhibition of [3H]5HT uptake at human 5HT transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 38 nM | Inhibition of [3H]NA uptake at human NA transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 38 nM | Inhibition of [3H]NA uptake at human NA transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 800 nM | Inhibition of [3H]dopamine uptake at human dopamine transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 800 nM | Inhibition of [3H]dopamine uptake at human dopamine transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
Ki (binding) | = 1757 nM | Binding affinity to human ERG | ChEMBL. | 18240382 |
Ki (binding) | = 1757 nM | Binding affinity to human ERG | ChEMBL. | 18240382 |
Papp (ADMET) | 0 | Membrane permeability by PAMPA assay | ChEMBL. | 18240382 |
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.