Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Equus caballus | Cholinesterase | Starlite/ChEMBL | References |
Electrophorus electricus | Acetylcholinesterase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Onchocerca volvulus | Acetylcholinesterase | 633 aa | 648 aa | 25.3 % | |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | Acetylcholinesterase | 633 aa | 622 aa | 24.9 % |
Onchocerca volvulus | Galectin homolog | Cholinesterase | 574 aa | 531 aa | 39.7 % |
Schistosoma japonicum | ko:K01050 cholinesterase [EC3.1.1.8], putative | Cholinesterase | 574 aa | 577 aa | 36.9 % |
Onchocerca volvulus | Molybdopterin synthase catalytic subunit homolog | Acetylcholinesterase | 633 aa | 576 aa | 28.8 % |
Echinococcus granulosus | neuroligin | Cholinesterase | 574 aa | 492 aa | 24.4 % |
Onchocerca volvulus | Cholinesterase | 574 aa | 551 aa | 29.9 % | |
Brugia malayi | Carboxylesterase family protein | Acetylcholinesterase | 633 aa | 517 aa | 25.1 % |
Echinococcus granulosus | BC026374 protein S09 family | Acetylcholinesterase | 633 aa | 690 aa | 31.7 % |
Loa Loa (eye worm) | hypothetical protein | Acetylcholinesterase | 633 aa | 576 aa | 23.4 % |
Onchocerca volvulus | Putative nuclear protein | Cholinesterase | 574 aa | 572 aa | 40.9 % |
Echinococcus multilocularis | neuroligin | Acetylcholinesterase | 633 aa | 507 aa | 23.9 % |
Brugia malayi | Carboxylesterase family protein | Acetylcholinesterase | 633 aa | 620 aa | 28.4 % |
Brugia malayi | Carboxylesterase family protein | Cholinesterase | 574 aa | 538 aa | 31.4 % |
Onchocerca volvulus | Cholinesterase | 574 aa | 578 aa | 25.3 % | |
Schistosoma mansoni | gliotactin | Cholinesterase | 574 aa | 587 aa | 27.9 % |
Drosophila melanogaster | CG10175 gene product from transcript CG10175-RE | Acetylcholinesterase | 633 aa | 549 aa | 30.4 % |
Loa Loa (eye worm) | hypothetical protein | Acetylcholinesterase | 633 aa | 597 aa | 25.1 % |
Onchocerca volvulus | Carnitine O-palmitoyltransferase 2, mitochondrial homolog | Cholinesterase | 574 aa | 554 aa | 36.1 % |
Echinococcus multilocularis | BC026374 protein (S09 family) | Acetylcholinesterase | 633 aa | 690 aa | 32.3 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Plasmodium vivax | SWIB/MDM2 domain-containing protein, putative | 0.0427 | 1 | 0.5 |
Loa Loa (eye worm) | brahma associated protein | 0.0427 | 1 | 1 |
Onchocerca volvulus | 0.0427 | 1 | 1 | |
Chlamydia trachomatis | SWIB complex protein | 0.0427 | 1 | 0.5 |
Brugia malayi | brahma associated protein 60 kDa | 0.0427 | 1 | 1 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.0433 | 0.0433 |
Brugia malayi | SWIB/MDM2 domain containing protein | 0.0427 | 1 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0427 | 1 | 1 |
Plasmodium falciparum | SWIB/MDM2 domain-containing protein | 0.0427 | 1 | 1 |
Chlamydia trachomatis | DNA topoisomerase I | 0.0427 | 1 | 0.5 |
Leishmania major | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Leishmania major | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Echinococcus granulosus | SWI:SNF matrix associated | 0.0427 | 1 | 1 |
Echinococcus multilocularis | SWI:SNF matrix associated | 0.0427 | 1 | 1 |
Leishmania major | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | mitochondrial RNA binding complex 1 subunit, putative | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | Zn-finger in Ran binding protein and others, putative | 0.0152 | 0 | 0.5 |
Echinococcus multilocularis | Upstream activation factor subunit UAF30 | 0.0427 | 1 | 1 |
Plasmodium vivax | hypothetical protein, conserved | 0.0427 | 1 | 0.5 |
Schistosoma mansoni | brg-1 associated factor | 0.0427 | 1 | 1 |
Plasmodium falciparum | SWIB/MDM2 domain-containing protein | 0.0427 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0427 | 1 | 0.5 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.0433 | 0.0433 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.0433 | 0.0433 |
Trypanosoma brucei | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Trypanosoma brucei | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.0433 | 0.0433 |
Echinococcus multilocularis | SWI:SNF matrix associated | 0.0427 | 1 | 1 |
Trypanosoma cruzi | Zn-finger in Ran binding protein and others, putative | 0.0152 | 0 | 0.5 |
Trypanosoma brucei | mitochondrial RNA binding complex 1 subunit | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.0433 | 0.0433 |
Toxoplasma gondii | DNA topoisomerase domain-containing protein | 0.0427 | 1 | 1 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.0433 | 0.0433 |
Trypanosoma cruzi | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.0433 | 0.0433 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.0433 | 0.0433 |
Echinococcus multilocularis | SWI:SNF matrix associated | 0.0427 | 1 | 1 |
Loa Loa (eye worm) | SWIB/MDM2 domain-containing protein | 0.0427 | 1 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0427 | 1 | 1 |
Leishmania major | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | WLM domain containing protein, putative | 0.0152 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.0433 | 0.0433 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.0433 | 0.0433 |
Echinococcus granulosus | Upstream activation factor subunit UAF30 | 0.0427 | 1 | 1 |
Trypanosoma cruzi | Zn-finger in Ran binding protein and others/FYVE zinc finger, putative | 0.0152 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.0433 | 0.0433 |
Trypanosoma cruzi | mitochondrial RNA binding complex 1 subunit, putative | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | WLM domain containing protein, putative | 0.0152 | 0 | 0.5 |
Trypanosoma cruzi | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.0427 | 1 | 1 |
Leishmania major | hypothetical protein, conserved | 0.0152 | 0 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.0433 | 0.0433 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.0433 | 0.0433 |
Toxoplasma gondii | SWIB/MDM2 domain-containing protein | 0.0427 | 1 | 1 |
Trypanosoma brucei | Zn-finger in Ran binding protein and others/FYVE zinc finger, putative | 0.0152 | 0 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 0.21 uM | Inhibition of Electrophorus electricus AChE using acetylthiocholine chloride as substrate after 15 mins incubation by Ellman's method | ChEMBL. | 22341944 |
IC50 (binding) | = 2.81 uM | Inhibition of equine serum BChE after 15 mins incubation by spectrophotometry based Ellman's method | ChEMBL. | 22341944 |
Inhibition (binding) | = 74.4 % | Inhibition of Electrophorus electricus AChE-induced beta-amyloid (1 to 40) aggregation at 10 uM after 8 hrs by thioflavin-T based fluorescence assay | ChEMBL. | 22341944 |
Inhibition (binding) | = 93.5 % | Inhibition of Electrophorus electricus AChE-induced beta-amyloid (1 to 40) aggregation at 100 uM after 8 hrs by thioflavin-T based fluorescence assay | ChEMBL. | 22341944 |
Ki (binding) | = 0.26 uM | Non-competitive inhibition of Electrophorus electricus AChE assessed as hydrolysis of acetylthiocholineiodide after 15 mins incubation by spectrophotometry | ChEMBL. | 22341944 |
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.