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 |
---|---|---|---|---|
Echinococcus multilocularis | semaphorin 5B | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0164 | 0.5182 | 0.631 |
Echinococcus granulosus | exocyst complex component 2 | 0.0047 | 0.0733 | 0.0733 |
Echinococcus granulosus | semaphorin 1A | 0.0107 | 0.3025 | 0.3025 |
Echinococcus multilocularis | exocyst complex component 2 | 0.0047 | 0.0733 | 0.0733 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5182 | 0.5182 |
Echinococcus multilocularis | transcription factor collier | 0.0047 | 0.0733 | 0.0733 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Entamoeba histolytica | protein kinase domain containing protein | 0.0059 | 0.1211 | 1 |
Brugia malayi | Plexin repeat family protein | 0.0243 | 0.8213 | 0.8213 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.5182 | 0.5182 |
Echinococcus granulosus | transcription factor collier | 0.0047 | 0.0733 | 0.0733 |
Echinococcus granulosus | potassium voltage gated channel subfamily H | 0.0037 | 0.0344 | 0.0344 |
Brugia malayi | Voltage-gated potassium channel, HERG (KCNH2)-related. C. elegans unc-103 ortholog | 0.0037 | 0.0344 | 0.0344 |
Loa Loa (eye worm) | voltage and ligand gated potassium channel | 0.0037 | 0.0344 | 0.0344 |
Loa Loa (eye worm) | carboxylesterase | 0.0164 | 0.5182 | 0.5182 |
Schistosoma mansoni | semaphorin 5-related | 0.0107 | 0.3025 | 0.3683 |
Echinococcus multilocularis | potassium voltage gated channel subfamily H | 0.0037 | 0.0344 | 0.0344 |
Schistosoma mansoni | voltage-gated potassium channel | 0.004 | 0.0473 | 0.0576 |
Echinococcus multilocularis | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | voltage-gated potassium channel | 0.004 | 0.0473 | 0.0576 |
Schistosoma mansoni | plexin | 0.0136 | 0.4134 | 0.5034 |
Loa Loa (eye worm) | hypothetical protein | 0.0032 | 0.016 | 0.016 |
Schistosoma mansoni | hypothetical protein | 0.0047 | 0.0733 | 0.0893 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0107 | 0.3025 | 0.3683 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0034 | 0.0252 | 0.3441 |
Loa Loa (eye worm) | hypothetical protein | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0028 | 0 | 0.5 |
Brugia malayi | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Onchocerca volvulus | 0.0243 | 0.8213 | 1 | |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Mycobacterium tuberculosis | POSSIBLE PARA-NITROBENZYL ESTERASE (FRAGMENT) | 0.0028 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Mycobacterium ulcerans | carboxylesterase, LipT | 0.0028 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0164 | 0.5182 | 0.5182 |
Brugia malayi | IPT/TIG domain containing protein | 0.0047 | 0.0733 | 0.0733 |
Schistosoma mansoni | fibrocystin l | 0.0047 | 0.0733 | 0.0893 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Echinococcus granulosus | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Brugia malayi | Sema domain containing protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus granulosus | semaphorin 5B | 0.0107 | 0.3025 | 0.3025 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Entamoeba histolytica | tyrosin kinase, putative | 0.0059 | 0.1211 | 1 |
Brugia malayi | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus granulosus | carboxylesterase 5A | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0243 | 0.8213 | 0.8213 |
Loa Loa (eye worm) | plexin A | 0.029 | 1 | 1 |
Brugia malayi | DNA-binding protein LAG-1 | 0.0047 | 0.0733 | 0.0733 |
Echinococcus granulosus | plexin a4 | 0.029 | 1 | 1 |
Loa Loa (eye worm) | sema domain-containing protein | 0.0107 | 0.3025 | 0.3025 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Echinococcus multilocularis | plexin a4 | 0.029 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0047 | 0.0733 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0107 | 0.3025 | 0.3683 |
Schistosoma mansoni | plexin | 0.0243 | 0.8213 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0047 | 0.0733 | 0.0893 |
Loa Loa (eye worm) | hypothetical protein | 0.0136 | 0.4134 | 0.4134 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Schistosoma mansoni | hypothetical protein | 0.0136 | 0.4134 | 0.5034 |
Trichomonas vaginalis | Clan MA, family M8, leishmanolysin-like metallopeptidase | 0.0047 | 0.0733 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0047 | 0.0733 | 0.0733 |
Echinococcus multilocularis | acetylcholinesterase | 0.0164 | 0.5182 | 0.5182 |
Mycobacterium tuberculosis | Carboxylesterase LipT | 0.0028 | 0 | 0.5 |
Trichomonas vaginalis | voltage and ligand gated potassium channel, putative | 0.0034 | 0.0252 | 0.3441 |
Brugia malayi | Probable exocyst complex component Sec5 | 0.0047 | 0.0733 | 0.0733 |
Brugia malayi | Carboxylesterase family protein | 0.0164 | 0.5182 | 0.5182 |
Brugia malayi | Sema domain containing protein | 0.0107 | 0.3025 | 0.3025 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0164 | 0.5182 | 0.5182 |
Loa Loa (eye worm) | hypothetical protein | 0.0107 | 0.3025 | 0.3025 |
Loa Loa (eye worm) | sema domain-containing protein | 0.0107 | 0.3025 | 0.3025 |
Onchocerca volvulus | 0.0107 | 0.3025 | 0.3683 |
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.