Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Electrophorus electricus | Acetylcholinesterase | Starlite/ChEMBL | References |
Equus caballus | Cholinesterase | Starlite/ChEMBL | References |
Rattus norvegicus | Monoamine oxidase B | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Onchocerca volvulus | Putative nuclear protein | Cholinesterase | 574 aa | 572 aa | 40.9 % |
Dictyostelium discoideum | amine oxidase | Monoamine oxidase B | 520 aa | 489 aa | 29.0 % |
Onchocerca volvulus | Cholinesterase | 574 aa | 551 aa | 29.9 % | |
Brugia malayi | Carboxylesterase family protein | Cholinesterase | 574 aa | 538 aa | 31.4 % |
Onchocerca volvulus | Acetylcholinesterase | 633 aa | 648 aa | 25.3 % | |
Echinococcus granulosus | BC026374 protein S09 family | Acetylcholinesterase | 633 aa | 690 aa | 31.7 % |
Schistosoma japonicum | ko:K01050 cholinesterase [EC3.1.1.8], putative | Cholinesterase | 574 aa | 577 aa | 36.9 % |
Echinococcus multilocularis | neuroligin | Acetylcholinesterase | 633 aa | 507 aa | 23.9 % |
Onchocerca volvulus | Galectin homolog | Cholinesterase | 574 aa | 531 aa | 39.7 % |
Brugia malayi | Carboxylesterase family protein | Acetylcholinesterase | 633 aa | 517 aa | 25.1 % |
Echinococcus granulosus | neuroligin | Cholinesterase | 574 aa | 492 aa | 24.4 % |
Brugia malayi | amine oxidase, flavin-containing family protein | Monoamine oxidase B | 520 aa | 479 aa | 21.7 % |
Echinococcus multilocularis | BC026374 protein (S09 family) | Acetylcholinesterase | 633 aa | 690 aa | 32.3 % |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | Acetylcholinesterase | 633 aa | 622 aa | 24.9 % |
Dictyostelium discoideum | hypothetical protein | Monoamine oxidase B | 520 aa | 531 aa | 23.2 % |
Loa Loa (eye worm) | hypothetical protein | Acetylcholinesterase | 633 aa | 576 aa | 23.4 % |
Onchocerca volvulus | Carnitine O-palmitoyltransferase 2, mitochondrial homolog | Cholinesterase | 574 aa | 554 aa | 36.1 % |
Onchocerca volvulus | Molybdopterin synthase catalytic subunit homolog | Acetylcholinesterase | 633 aa | 576 aa | 28.8 % |
Dictyostelium discoideum | hypothetical protein | Monoamine oxidase B | 520 aa | 539 aa | 22.3 % |
Brugia malayi | Carboxylesterase family protein | Acetylcholinesterase | 633 aa | 620 aa | 28.4 % |
Loa Loa (eye worm) | hypothetical protein | Acetylcholinesterase | 633 aa | 597 aa | 25.1 % |
Schistosoma mansoni | gliotactin | Cholinesterase | 574 aa | 587 aa | 27.9 % |
Dictyostelium discoideum | hypothetical protein | Monoamine oxidase B | 520 aa | 538 aa | 21.0 % |
Onchocerca volvulus | Cholinesterase | 574 aa | 578 aa | 25.3 % | |
Onchocerca volvulus | Mitochondrial fission process protein 1 homolog | Monoamine oxidase B | 520 aa | 469 aa | 22.0 % |
Drosophila melanogaster | CG10175 gene product from transcript CG10175-RE | Acetylcholinesterase | 633 aa | 549 aa | 30.4 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.4111 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.4111 | 1 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.4111 | 1 |
Trichomonas vaginalis | carboxylesterase domain containing protein, putative | 0.0028 | 0 | 0.5 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.4111 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.4111 | 1 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.4111 | 1 |
Onchocerca volvulus | 0.0028 | 0 | 0.5 | |
Trichomonas vaginalis | spcc417.12 protein, putative | 0.0028 | 0 | 0.5 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.4111 | 1 |
Onchocerca volvulus | 0.0028 | 0 | 0.5 | |
Onchocerca volvulus | 0.0028 | 0 | 0.5 | |
Onchocerca volvulus | 0.0028 | 0 | 0.5 | |
Mycobacterium tuberculosis | Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) | 0.0333 | 0.9237 | 1 |
Onchocerca volvulus | 0.0028 | 0 | 0.5 | |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.4111 | 1 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.4111 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.4111 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.4111 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.4111 | 1 |
Mycobacterium ulcerans | flavin-containing monoamine oxidase AofH | 0.0359 | 1 | 1 |
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.4111 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 0.24 uM | Inhibition of equine serum BuChE by spectrophotometric Ellman's method | ChEMBL. | 26107513 |
IC50 (binding) | = 3.7 uM | Inhibition of rat brain MAO-B using kynuramine substrate in rat mitochondrial substrate by spectrophotometric assay | ChEMBL. | 26107513 |
IC50 (binding) | = 7.1 uM | Inhibition of electric eel AChE by spectrophotometric Ellman's method | ChEMBL. | 26107513 |
Inhibition (binding) | = 17 % | Inhibition of rat brain MAO-A using kynuramine substrate in rat mitochondrial substrate at 10 uM by spectrophotometric assay | ChEMBL. | 26107513 |
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.