Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | diacylglycerol O-acyltransferase 1 | Starlite/ChEMBL | No references |
Homo sapiens | sterol O-acyltransferase 1 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Toxoplasma gondii | acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha | sterol O-acyltransferase 1 | 492 aa | 413 aa | 25.9 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trypanosoma cruzi | metacaspase 5, putative | 0.0132 | 0 | 0.5 |
Brugia malayi | diacylglycerol acyltransferase | 0.0179 | 0.0315 | 0.0315 |
Onchocerca volvulus | Cell death protein 3 homolog | 0.0367 | 0.1579 | 0.5 |
Echinococcus multilocularis | diacylglycerol O acyltransferase 1 | 0.0179 | 0.0315 | 0.0315 |
Leishmania major | metacaspase, putative | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Trypanosoma cruzi | metacaspase, putative | 0.0132 | 0 | 0.5 |
Toxoplasma gondii | acyl-CoA:diacylglycerol acyltransferase 1-related enzyme | 0.0179 | 0.0315 | 1 |
Trypanosoma brucei | metacaspase 5, putative | 0.0132 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0238 | 0.0712 | 0.0712 |
Echinococcus granulosus | alpha 16 mannosyl glycoprotein | 0.1619 | 1 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Trypanosoma cruzi | metacaspase 5, putative | 0.0132 | 0 | 0.5 |
Echinococcus granulosus | sterol O acyltransferase 1 | 0.029 | 0.1059 | 0.1059 |
Echinococcus multilocularis | sterol O acyltransferase 1 | 0.029 | 0.1059 | 0.1059 |
Loa Loa (eye worm) | hypothetical protein | 0.029 | 0.1059 | 0.1059 |
Trypanosoma cruzi | metacaspase, putative | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Echinococcus multilocularis | caspase 2 | 0.0367 | 0.1579 | 0.1579 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Schistosoma mansoni | beta-12-n-acetylglucosaminyltransferase II | 0.1619 | 1 | 1 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Schistosoma mansoni | caspase-7 (C14 family) | 0.0367 | 0.1579 | 0.1579 |
Echinococcus granulosus | caspase 3 apoptosis cysteine peptidase | 0.026 | 0.0861 | 0.0861 |
Trypanosoma brucei | metacaspase MCA3 | 0.0132 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.1619 | 1 | 1 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Echinococcus granulosus | diacylglycerol O acyltransferase 1 | 0.0179 | 0.0315 | 0.0315 |
Echinococcus multilocularis | alpha 1,6 mannosyl glycoprotein | 0.1619 | 1 | 1 |
Echinococcus granulosus | caspase 2 | 0.0367 | 0.1579 | 0.1579 |
Trypanosoma brucei | Metacaspase-4 | 0.0132 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0367 | 0.1579 | 0.1579 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Plasmodium vivax | diacylglycerol O-acyltransferase, putative | 0.0179 | 0.0315 | 1 |
Trypanosoma brucei | metacaspase MCA2 | 0.0132 | 0 | 0.5 |
Toxoplasma gondii | acyl-CoA:cholesterol acyltransferase alpha ACAT1-alpha | 0.0179 | 0.0315 | 1 |
Echinococcus multilocularis | caspase 3, apoptosis cysteine peptidase | 0.026 | 0.0861 | 0.0861 |
Trypanosoma brucei | metacaspase | 0.0132 | 0 | 0.5 |
Echinococcus multilocularis | caspase | 0.026 | 0.0861 | 0.0861 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Schistosoma mansoni | caspase-7 (C14 family) | 0.026 | 0.0861 | 0.0861 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Schistosoma mansoni | caspase-3 (C14 family) | 0.026 | 0.0861 | 0.0861 |
Brugia malayi | Cell death protein 3 precursor | 0.0367 | 0.1579 | 0.1579 |
Trypanosoma cruzi | metacaspase, putative | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0132 | 0 | 0.5 |
Plasmodium falciparum | diacylglycerol O-acyltransferase | 0.0179 | 0.0315 | 1 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Echinococcus granulosus | caspase | 0.026 | 0.0861 | 0.0861 |
Schistosoma mansoni | diacylglycerol O-acyltransferase 1 | 0.0179 | 0.0315 | 0.0315 |
Schistosoma mansoni | sterol O-acyltransferase 1 | 0.029 | 0.1059 | 0.1059 |
Trypanosoma cruzi | metacaspase, putative | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Trichomonas vaginalis | Clan CD, family C14, metacaspase-like cysteine peptidase | 0.0132 | 0 | 0.5 |
Loa Loa (eye worm) | diacylglycerol acyltransferase | 0.0179 | 0.0315 | 0.0315 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Fu (ADMET) | = 0.3 % | Fraction unbound in human plasma | ChEMBL. | No reference |
IC50 (binding) | = 6 | Inhibition of human ACAT1 | ChEMBL. | No reference |
IC50 (binding) | = 8.1 | Inhibition of recombinant human DGAT1 expressed in sf9 cell membrane assessed as inhibition of radioactive trioleoylglycerol formation after 30 mins by liquid scintillation counting | ChEMBL. | No reference |
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.