Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | solute carrier family 6 (neurotransmitter transporter), member 4 | 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 |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Sodium:neurotransmitter symporter family protein | solute carrier family 6 (neurotransmitter transporter), member 3 | 620 aa | 579 aa | 33.2 % |
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 4 | 630 aa | 574 aa | 31.5 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Brugia malayi | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.005 | 0.0203 | 0.0018 |
Echinococcus granulosus | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Toxoplasma gondii | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Loa Loa (eye worm) | serotonin transporter b | 0.0292 | 0.4716 | 0.4716 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.0292 | 0.4716 | 0.4616 |
Mycobacterium leprae | DIHYDROFOLATE REDUCTASE DFRA (DHFR) (TETRAHYDROFOLATE DEHYDROGENASE) | 0.0576 | 1 | 1 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
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) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Brugia malayi | hypothetical protein | 0.005 | 0.0203 | 0.0095 |
Echinococcus multilocularis | dihydrofolate reductase | 0.0576 | 1 | 1 |
Mycobacterium tuberculosis | Probable thymidylate synthase ThyA (ts) (TSASE) | 0.0111 | 0.1339 | 0.1108 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.0292 | 0.4716 | 0.4657 |
Loa Loa (eye worm) | dihydrofolate reductase | 0.0576 | 1 | 1 |
Plasmodium falciparum | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Echinococcus multilocularis | thymidylate synthase | 0.0111 | 0.1339 | 0.1243 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Loa Loa (eye worm) | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0203 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | solute carrier family 6 member 4 | 0.0292 | 0.4716 | 0.4716 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Brugia malayi | hypothetical protein | 0.0053 | 0.026 | 0.0152 |
Echinococcus granulosus | dihydrofolate reductase | 0.0576 | 1 | 1 |
Echinococcus granulosus | serotonin transporter | 0.0292 | 0.4716 | 0.4657 |
Echinococcus granulosus | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.005 | 0.0203 | 0.0018 |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Brugia malayi | Dihydrofolate reductase | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium-dependent amino acid transporter | 0.005 | 0.0203 | 0.0018 |
Schistosoma mansoni | dihydrofolate reductase | 0.0576 | 1 | 1 |
Schistosoma mansoni | sodium-dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Echinococcus granulosus | sodium:chloride dependent neurotransmitter | 0.005 | 0.0203 | 0.0095 |
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 |
Leishmania major | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 0.5 |
Echinococcus granulosus | sodium dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0095 |
Echinococcus granulosus | uncharacterized sodium dependent transporter | 0.005 | 0.0203 | 0.0095 |
Echinococcus multilocularis | uncharacterized sodium dependent transporter | 0.005 | 0.0203 | 0.0095 |
Trypanosoma cruzi | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 1 |
Onchocerca volvulus | 0.0111 | 0.1339 | 0.2518 | |
Schistosoma mansoni | bifunctional dihydrofolate reductase-thymidylate synthase | 0.0111 | 0.1339 | 0.1175 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0053 | 0.026 | 1 |
Schistosoma mansoni | sodium/chloride dependent transporter | 0.005 | 0.0203 | 0.0018 |
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 |
Echinococcus multilocularis | sodium dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0095 |
Onchocerca volvulus | 0.0292 | 0.4716 | 1 | |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Mycobacterium ulcerans | dihydrofolate reductase DfrA | 0.0576 | 1 | 1 |
Plasmodium vivax | bifunctional dihydrofolate reductase-thymidylate synthase, putative | 0.0359 | 0.5956 | 1 |
Loa Loa (eye worm) | norepinephrine transporter | 0.0292 | 0.4716 | 0.4716 |
Echinococcus multilocularis | sodium:chloride dependent neurotransmitter | 0.005 | 0.0203 | 0.0095 |
Brugia malayi | Sodium:neurotransmitter symporter family protein 1, putative | 0.005 | 0.0203 | 0.0095 |
Echinococcus multilocularis | serotonin transporter | 0.0292 | 0.4716 | 0.4657 |
Loa Loa (eye worm) | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0203 |
Chlamydia trachomatis | dihydrofolate reductase | 0.0576 | 1 | 1 |
Echinococcus multilocularis | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Loa Loa (eye worm) | hypothetical protein | 0.005 | 0.0203 | 0.0203 |
Loa Loa (eye worm) | voltage and ligand gated potassium channel | 0.0045 | 0.0109 | 0.0109 |
Loa Loa (eye worm) | hypothetical protein | 0.0292 | 0.4716 | 0.4716 |
Loa Loa (eye worm) | thymidylate synthase | 0.0111 | 0.1339 | 0.1339 |
Brugia malayi | Sodium:neurotransmitter symporter family protein | 0.005 | 0.0203 | 0.0095 |
Schistosoma mansoni | norepinephrine/norepinephrine transporter | 0.0292 | 0.4716 | 0.4616 |
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 |
Trypanosoma brucei | dihydrofolate reductase-thymidylate synthase | 0.0359 | 0.5956 | 0.5 |
Schistosoma mansoni | sodium-dependent neurotransmitter transporter | 0.005 | 0.0203 | 0.0018 |
Echinococcus multilocularis | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Mycobacterium tuberculosis | Dihydrofolate reductase DfrA (DHFR) (tetrahydrofolate dehydrogenase) | 0.0576 | 1 | 1 |
Echinococcus granulosus | sodium and chloride dependent glycine | 0.005 | 0.0203 | 0.0095 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
CL (ADMET) | = 13 microL/min/mg | Metabolic stability assessed as intrinsic clearance in human liver microsomes | ChEMBL. | 18240382 |
IC50 (binding) | = 11 nM | Inhibition of [3H]5HT uptake at human 5HT transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 11 nM | Inhibition of [3H]5HT uptake at human 5HT transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 33 nM | Inhibition of [3H]NA uptake at human NA transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 33 nM | Inhibition of [3H]NA uptake at human NA transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 275 nM | Inhibition of [3H]dopamine uptake at human dopamine transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
IC50 (binding) | = 275 nM | Inhibition of [3H]dopamine uptake at human dopamine transporter expressed in HEK293 cells | ChEMBL. | 18240382 |
Ki (binding) | Binding affinity to human ERG | ChEMBL. | 18240382 | |
Ki (binding) | 0 | Binding affinity to human ERG | ChEMBL. | 18240382 |
Papp (ADMET) | = 14 10^6cm/s | 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.