Species | Target name | Source | Bibliographic reference |
---|---|---|---|
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 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | carboxylesterase | 0.0082 | 0.0542 | 0.1268 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-40 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | photoreceptor-specific nuclear receptor | 0.0049 | 0.0038 | 0.009 |
Echinococcus granulosus | carboxylesterase 5A | 0.0082 | 0.0542 | 0.1189 |
Brugia malayi | GH02984p | 0.0325 | 0.4276 | 1 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-31 | 0.0049 | 0.0038 | 0.009 |
Echinococcus granulosus | high affinity choline transporter 1 | 0.0325 | 0.4276 | 1 |
Brugia malayi | Nuclear hormone receptor family member nhr-14 | 0.0049 | 0.0038 | 0.009 |
Echinococcus multilocularis | acetylcholinesterase | 0.0082 | 0.0542 | 0.1189 |
Brugia malayi | Nuclear hormone receptor family member nhr-25 | 0.0049 | 0.0038 | 0.009 |
Echinococcus granulosus | ribonuclease H1 | 0.0186 | 0.2142 | 0.4963 |
Loa Loa (eye worm) | hypothetical protein | 0.0325 | 0.4276 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0241 | 0.2985 | 0.6981 |
Brugia malayi | nuclear hormone receptor | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | hypothetical protein | 0.0082 | 0.0542 | 0.1268 |
Echinococcus multilocularis | ribonuclease H1 | 0.0186 | 0.2142 | 0.4963 |
Brugia malayi | Steroid receptor seven-up type 2 | 0.0049 | 0.0038 | 0.009 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0082 | 0.0542 | 0.1189 |
Trypanosoma brucei | hypothetical protein, conserved | 0.0202 | 0.2384 | 0.0309 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-1 | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-41 | 0.0049 | 0.0038 | 0.009 |
Trypanosoma cruzi | ribonuclease H1, putative | 0.0186 | 0.2142 | 0.5 |
Echinococcus multilocularis | geminin | 0.0203 | 0.2407 | 0.5589 |
Echinococcus granulosus | geminin | 0.0203 | 0.2407 | 0.5589 |
Trypanosoma brucei | unspecified product | 0.0202 | 0.2384 | 0.0309 |
Brugia malayi | Nuclear hormone receptor family member nhr-41 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | nuclear receptor NHR-88 | 0.0049 | 0.0038 | 0.009 |
Treponema pallidum | ribonuclease H (rnhA) | 0.0186 | 0.2142 | 0.5 |
Echinococcus multilocularis | acetylcholinesterase | 0.0082 | 0.0542 | 0.1189 |
Schistosoma mansoni | phosphoglucomutase | 0.0186 | 0.2142 | 0.2111 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Nuclear hormone receptor family member nhr-19 | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Trypanosoma brucei | retrotransposon hot spot protein 4 (RHS4), interrupted | 0.0202 | 0.2384 | 0.0309 |
Brugia malayi | Nuclear hormone receptor family member nhr-31 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | RNase H family protein | 0.0186 | 0.2142 | 0.5009 |
Brugia malayi | Nuclear hormone receptor family member nhr-40 | 0.0049 | 0.0038 | 0.009 |
Trypanosoma cruzi | ribonuclease H1, putative | 0.0186 | 0.2142 | 0.5 |
Brugia malayi | Nuclear hormone receptor family member nhr-1 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Carboxylesterase family protein | 0.0082 | 0.0542 | 0.1268 |
Brugia malayi | Nuclear hormone receptor family member nhr-19 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Carboxylesterase family protein | 0.0082 | 0.0542 | 0.1268 |
Schistosoma mansoni | phosphoglucomutase | 0.0186 | 0.2142 | 0.2111 |
Brugia malayi | Nuclear hormone receptor family member nhr-3 | 0.0049 | 0.0038 | 0.009 |
Echinococcus granulosus | acetylcholinesterase | 0.0082 | 0.0542 | 0.1189 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Schistosoma mansoni | hypothetical protein | 0.0203 | 0.2407 | 0.2377 |
Onchocerca volvulus | Ribonuclease H1 homolog | 0.0186 | 0.2142 | 0.5683 |
Leishmania major | ribonuclease H1, putative | 0.0186 | 0.2142 | 0.5 |
Loa Loa (eye worm) | nuclear receptor nhr-7B | 0.0264 | 0.3341 | 0.7814 |
Brugia malayi | nuclear hormone receptor | 0.0264 | 0.3341 | 0.7814 |
Echinococcus multilocularis | high affinity choline transporter 1 | 0.0325 | 0.4276 | 1 |
Onchocerca volvulus | Steroid hormone receptor family member cnr14 homolog | 0.029 | 0.3739 | 1 |
Schistosoma mansoni | high-affinity choline transporter | 0.0325 | 0.4276 | 0.4254 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | steroid hormone receptor | 0.0049 | 0.0038 | 0.009 |
Trichomonas vaginalis | ribonuclease H1, putative | 0.0186 | 0.2142 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0082 | 0.0542 | 0.1268 |
Brugia malayi | Nuclear hormone receptor-like 1 | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Ligand-binding domain of nuclear hormone receptor family protein | 0.0049 | 0.0038 | 0.009 |
Schistosoma mansoni | hypothetical protein | 0.0203 | 0.2407 | 0.2377 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0082 | 0.0542 | 0.0506 |
Brugia malayi | RNase H family protein | 0.0186 | 0.2142 | 0.5009 |
Loa Loa (eye worm) | steroid hormone receptor | 0.0049 | 0.0038 | 0.009 |
Trypanosoma brucei | RNA helicase, putative | 0.0697 | 1 | 1 |
Loa Loa (eye worm) | nuclear Hormone Receptor family member | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-49 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | RNase H family protein | 0.0186 | 0.2142 | 0.5009 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0082 | 0.0542 | 0.1268 |
Toxoplasma gondii | ribonuclease HI protein | 0.0186 | 0.2142 | 0.5 |
Echinococcus granulosus | acetylcholinesterase | 0.0082 | 0.0542 | 0.1189 |
Trypanosoma brucei | ingi protein (ORF1) | 0.0202 | 0.2384 | 0.0309 |
Giardia lamblia | Ribonuclease H | 0.0186 | 0.2142 | 0.5 |
Brugia malayi | ecdysteroid receptor | 0.0049 | 0.0038 | 0.009 |
Trypanosoma brucei | ingi protein (ORF1) | 0.0202 | 0.2384 | 0.0309 |
Brugia malayi | Nuclear hormone receptor family member nhr-25 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Nuclear hormone receptor family member nhr-49 | 0.0049 | 0.0038 | 0.009 |
Loa Loa (eye worm) | nuclear hormone receptor family member nhr-14 | 0.0049 | 0.0038 | 0.009 |
Brugia malayi | Ligand-binding domain of nuclear hormone receptor family protein | 0.0049 | 0.0038 | 0.009 |
Wolbachia endosymbiont of Brugia malayi | ribonuclease HI | 0.0186 | 0.2142 | 0.5 |
Schistosoma mansoni | phosphoglucomutase | 0.0186 | 0.2142 | 0.2111 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Activity (ADMET) | 0 | Hydrolysis half life in RPMI-1650/FCS medium at pH 7.6 | ChEMBL. | 17335187 |
Activity (ADMET) | 0 | Hydrolysis half life in human serum at pH 6.8 | ChEMBL. | 17335187 |
CC50 (ADMET) | = 26.5 uM | Cytotoxicity against CEM/0 cells | ChEMBL. | 17328534 |
CC50 (ADMET) | = 31 uM | Cytotoxicity against human CEM cells | ChEMBL. | 18826203 |
CC50 (functional) | = 47 uM | The cytotoxicity of the compound was measured on wild type CEM/O cells. | ChEMBL. | 9554875 |
EC50 (functional) | = 0.14 ug ml-1 | Effective concentration that causes 50 % inhibition of HIV-1 in CEM/0 cells, was determined. | ChEMBL. | No reference |
EC50 (functional) | = 0.16 ug ml-1 | Effective concentration that causes 50 % inhibition of HIV-2 in CEM/0 cells, was determined. | ChEMBL. | No reference |
EC50 (functional) | = 0.35 ug ml-1 | Effective concentration that causes 50 % inhibition of HIV-2 in CEM/TK- cells, was determined. | ChEMBL. | No reference |
EC50 (functional) | = 0.1 uM | Antiviral activity against HIV1 in CEM/0 cells | ChEMBL. | 17335187 |
EC50 (functional) | = 0.13 uM | Antiviral activity against H1V2 in CEM/0 cells | ChEMBL. | 17328534 |
EC50 (functional) | = 0.13 uM | Antiviral activity against HIV2 ROD in CEM/0 cells | ChEMBL. | 17335187 |
EC50 (functional) | = 0.15 uM | Antiviral activity against HIV1 in CEM/0 cells | ChEMBL. | 17328534 |
EC50 (functional) | = 0.28 uM | Antiviral activity was measured on HIV-1 in wild-type CEM/O cells | ChEMBL. | 9554875 |
EC50 (functional) | = 0.28 uM | Anti-HIV-1 activity tested in human lymphocytic CEM cells | ChEMBL. | 15139762 |
EC50 (functional) | = 0.3 uM | Antiviral activity against H1V2 in TK-deficient CEM cells | ChEMBL. | 17328534 |
EC50 (functional) | = 0.5 uM | Antiviral activity was measured on HIV-2 in mutant thymidine kinase-deficient CEM/TK- cells | ChEMBL. | 9554875 |
EC50 (functional) | = 0.62 uM | Antiviral activity was measured on HIV-2 in wild-type CEM/O cells | ChEMBL. | 9554875 |
EC50 (functional) | = 0.9 uM | Antiviral activity against HIV2 ROD in CEM/TK- cells | ChEMBL. | 17335187 |
IC50 (binding) | = 0.77 uM | Inhibition of human serum BChE | ChEMBL. | 17328534 |
IC50 (binding) | = 0.77 uM | Inhibitory activity towards human butrylcholinesterase | ChEMBL. | 15139762 |
IC50 (binding) | = 0.77 uM | Inhibition of human serum BChE | ChEMBL. | 17328534 |
IC50 (binding) | > 50 uM | Inhibitory activity towards Electrophorus electricus acetylcholinesterase | ChEMBL. | 15139762 |
t1/2 (ADMET) | = 4 hr | Hydrolysis half life in CEM cell extracts at pH 6.9 | ChEMBL. | 17335187 |
T1/2 (ADMET) | = 4 hr | Hydrolysis half life in CEM cell extracts at pH 6.9 | ChEMBL. | 17335187 |
T1/2 (ADMET) | = 4 hr | Stability in human CEM cell extract assessed as hydrolysis half life at pH 6.9 | ChEMBL. | 18826203 |
t1/2 | = 4.4 hr | Hydrolytic stability in 25 mM phosphate buffer at pH 7.3, 37 degC | ChEMBL. | 17328534 |
t1/2 | = 4.4 hr | Chemical stability in phosphate buffer at pH 7.3 | ChEMBL. | 17335187 |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Homo sapiens | ChEMBL23 | 15139762 |
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.
3 literature references were collected for this gene.