Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | acetylcholinesterase (Yt blood group) | Starlite/ChEMBL | References |
Homo sapiens | butyrylcholinesterase | Starlite/ChEMBL | References |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Carboxylesterase family protein | butyrylcholinesterase | 602 aa | 546 aa | 30.2 % |
Brugia malayi | Carboxylesterase family protein | acetylcholinesterase (Yt blood group) | 614 aa | 510 aa | 26.5 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | plexin | 0.0136 | 0.4134 | 0.5034 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Loa Loa (eye worm) | sema domain-containing protein | 0.0107 | 0.3025 | 0.3025 |
Brugia malayi | IPT/TIG domain containing protein | 0.0047 | 0.0733 | 0.0733 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0034 | 0.0252 | 0.3441 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0028 | 0 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Schistosoma mansoni | plexin | 0.0243 | 0.8213 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Brugia malayi | Sema domain containing protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus multilocularis | potassium voltage gated channel subfamily H | 0.0037 | 0.0344 | 0.0344 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.5182 | 0.5182 |
Onchocerca volvulus | 0.0107 | 0.3025 | 0.3683 | |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0047 | 0.0733 | 0.0893 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0028 | 0 | 0.5 |
Loa Loa (eye worm) | plexin A | 0.029 | 1 | 1 |
Schistosoma mansoni | voltage-gated potassium channel | 0.004 | 0.0473 | 0.0576 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Schistosoma mansoni | hypothetical protein | 0.0107 | 0.3025 | 0.3683 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Brugia malayi | Probable exocyst complex component Sec5 | 0.0047 | 0.0733 | 0.0733 |
Echinococcus multilocularis | transcription factor collier | 0.0047 | 0.0733 | 0.0733 |
Echinococcus multilocularis | exocyst complex component 2 | 0.0047 | 0.0733 | 0.0733 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.5182 | 0.5182 |
Echinococcus multilocularis | semaphorin 5B | 0.0107 | 0.3025 | 0.3025 |
Mycobacterium ulcerans | carboxylesterase, LipT | 0.0028 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | hypothetical protein | 0.0047 | 0.0733 | 0.0893 |
Loa Loa (eye worm) | hypothetical protein | 0.0032 | 0.016 | 0.016 |
Loa Loa (eye worm) | sema domain-containing protein | 0.0107 | 0.3025 | 0.3025 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.5182 | 0.631 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5182 | 0.5182 |
Brugia malayi | Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog | 0.0037 | 0.0344 | 0.0344 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0034 | 0.0252 | 0.3441 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Loa Loa (eye worm) | hypothetical protein | 0.0136 | 0.4134 | 0.4134 |
Loa Loa (eye worm) | hypothetical protein | 0.0243 | 0.8213 | 0.8213 |
Onchocerca volvulus | 0.0243 | 0.8213 | 1 | |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Brugia malayi | DNA-binding protein LAG-1 | 0.0047 | 0.0733 | 0.0733 |
Echinococcus multilocularis | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Entamoeba histolytica | tyrosin kinase, putative | 0.0059 | 0.1211 | 1 |
Brugia malayi | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus granulosus | semaphorin 1A | 0.0107 | 0.3025 | 0.3025 |
Brugia malayi | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | hypothetical protein | 0.0136 | 0.4134 | 0.5034 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0107 | 0.3025 | 0.3683 |
Echinococcus granulosus | potassium voltage gated channel subfamily H | 0.0037 | 0.0344 | 0.0344 |
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.5182 | 0.5182 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Brugia malayi | Plexin repeat family protein | 0.0243 | 0.8213 | 0.8213 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus granulosus | plexin a4 | 0.029 | 1 | 1 |
Mycobacterium tuberculosis | Carboxylesterase LipT | 0.0028 | 0 | 0.5 |
Schistosoma mansoni | fibrocystin l | 0.0047 | 0.0733 | 0.0893 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Entamoeba histolytica | protein kinase domain containing protein | 0.0059 | 0.1211 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus granulosus | transcription factor collier | 0.0047 | 0.0733 | 0.0733 |
Schistosoma mansoni | semaphorin 5-related | 0.0107 | 0.3025 | 0.3683 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Echinococcus multilocularis | plexin a4 | 0.029 | 1 | 1 |
Echinococcus granulosus | exocyst complex component 2 | 0.0047 | 0.0733 | 0.0733 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Schistosoma mansoni | voltage-gated potassium channel | 0.004 | 0.0473 | 0.0576 |
Loa Loa (eye worm) | voltage and ligand gated potassium channel | 0.0037 | 0.0344 | 0.0344 |
Brugia malayi | Sema domain containing protein | 0.0107 | 0.3025 | 0.3025 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus granulosus | semaphorin 5B | 0.0107 | 0.3025 | 0.3025 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (binding) | = 1.42 uM | Inhibition of human BuChE pre-incubated for 5 mins before butylthiocholine substrate addition by Ellman's method | ChEMBL. | 25089370 |
IC50 (binding) | = 8.17 uM | Inhibition of human recombinant AChE pre-incubated for 5 mins before acetylthiocholine substrate addition by Ellman's method | ChEMBL. | 25089370 |
Ki (binding) | = 1.94 uM | Inhibition of human recombinant AChE assessed as dissociation constant for enzyme-inhibitor complex by Lineweaver-Burk plot | ChEMBL. | 25089370 |
Ki (binding) | = 92.8 uM | Inhibition of human recombinant AChE assessed as dissociation constant for enzyme-inhibitor-substrate complex by Lineweaver-Burk plot | ChEMBL. | 25089370 |
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.