Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trichomonas vaginalis | Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase | 0.0037 | 0 | 0.5 |
Brugia malayi | hypothetical protein | 0.0176 | 0.0223 | 0.0337 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.0058 | 0.0034 | 0.0051 |
Trypanosoma brucei | ubiquitin carboxyl-terminal hydrolase, putative | 0.0037 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0058 | 0.0034 | 0.0051 |
Loa Loa (eye worm) | hypothetical protein | 0.0143 | 0.017 | 0.0256 |
Loa Loa (eye worm) | matrix metalloproteinase | 0.1726 | 0.2707 | 0.4083 |
Echinococcus multilocularis | atpase aaa+ type core atpase aaa type core | 0.0946 | 0.1457 | 0.1457 |
Brugia malayi | Matrix metalloprotease, N-terminal domain containing protein | 0.2102 | 0.331 | 0.4993 |
Loa Loa (eye worm) | hypothetical protein | 0.1726 | 0.2707 | 0.4083 |
Loa Loa (eye worm) | hypothetical protein | 0.1726 | 0.2707 | 0.4083 |
Trypanosoma cruzi | ubiquitin carboxyl-terminal hydrolase, putative | 0.0037 | 0 | 0.5 |
Brugia malayi | latrophilin 2 splice variant baaae | 0.004 | 0.0004 | 0.0007 |
Onchocerca volvulus | Matrilysin homolog | 0.3828 | 0.6077 | 1 |
Onchocerca volvulus | 0.1726 | 0.2707 | 0.4296 | |
Leishmania major | ubiquitin hydrolase, putative,cysteine peptidase, Clan CA, family C19, putative | 0.0037 | 0 | 0.5 |
Brugia malayi | Matrixin family protein | 0.1726 | 0.2707 | 0.4083 |
Brugia malayi | Matrixin family protein | 0.1726 | 0.2707 | 0.4083 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0037 | 0 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.004 | 0.0004 | 0.0008 |
Brugia malayi | Hemopexin family protein | 0.2447 | 0.3864 | 0.5827 |
Trypanosoma cruzi | ubiquitin carboxyl-terminal hydrolase, putative | 0.0037 | 0 | 0.5 |
Schistosoma mansoni | hypothetical protein | 0.2447 | 0.3864 | 0.7106 |
Loa Loa (eye worm) | hypothetical protein | 0.1726 | 0.2707 | 0.4083 |
Brugia malayi | Matrixin family protein | 0.4173 | 0.663 | 1 |
Onchocerca volvulus | Matrilysin homolog | 0.1726 | 0.2707 | 0.4296 |
Mycobacterium ulcerans | hydrolase | 0.2102 | 0.331 | 0.5 |
Brugia malayi | hypothetical protein | 0.0143 | 0.017 | 0.0256 |
Loa Loa (eye worm) | hypothetical protein | 0.0176 | 0.0223 | 0.0337 |
Onchocerca volvulus | Matrix metalloproteinase homolog | 0.3828 | 0.6077 | 1 |
Giardia lamblia | Ubiquitin carboxyl-terminal hydrolase 4 | 0.0037 | 0 | 0.5 |
Loa Loa (eye worm) | matrixin family protein | 0.3828 | 0.6077 | 0.9166 |
Onchocerca volvulus | 0.0176 | 0.0223 | 0.009 | |
Loa Loa (eye worm) | hypothetical protein | 0.2102 | 0.331 | 0.4993 |
Schistosoma mansoni | matrix metallopeptidase-7 (M10 family) | 0.1726 | 0.2707 | 0.4979 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.0058 | 0.0034 | 0.0051 |
Echinococcus multilocularis | matrix metallopeptidase 7 (M10 family) | 0.6275 | 1 | 1 |
Schistosoma mansoni | matrix metallopeptidase-9 (M10 family) | 0.3429 | 0.5437 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0143 | 0.017 | 0.0256 |
Brugia malayi | Matrixin family protein | 0.1726 | 0.2707 | 0.4083 |
Loa Loa (eye worm) | matrixin family protein | 0.4173 | 0.663 | 1 |
Entamoeba histolytica | ubiquitin carboxyl-terminal hydrolase domain containing protein | 0.0037 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.004 | 0.0004 | 0.0007 |
Trichomonas vaginalis | Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase | 0.0037 | 0 | 0.5 |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.0058 | 0.0034 | 0.0051 |
Mycobacterium tuberculosis | Probable peptidoglycan hydrolase | 0.2102 | 0.331 | 0.5 |
Mycobacterium leprae | PROBABLE HYDROLASE | 0.2102 | 0.331 | 0.5 |
Onchocerca volvulus | 0.2447 | 0.3864 | 0.6253 | |
Brugia malayi | Matrixin family protein | 0.1726 | 0.2707 | 0.4083 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
CC50 (ADMET) | = 29.21 uM | Cytotoxicity against mouse J774A1 cells after 72 hrs by MTT assay | ChEMBL. | 20371140 |
IC50 (functional) | = 57.78 uM | Antileishmanial activity against Leishmania donovani (MHOM/IN/Dd8) amastigote infected in mouse J774 cells assessed as after 72 hrs by luminometry | ChEMBL. | 20371140 |
Inhibition (functional) | = 99.9 % | Antileishmanial activity against Leishmania donovani MHOM/IN/Dd8 promastigote carrying firefly luciferase gene infected in mouse J774A1 cells assessed as relative luminescence unit at 40 ug/mL after 72 hrs | ChEMBL. | 20371140 |
MIC (functional) | = 68.69 uM | Antileishmanial activity against Leishmania donovani (MHOM/IN/Dd8) amastigote infected in mouse J774 cells assessed as after 72 hrs by luminometry | ChEMBL. | 20371140 |
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.