Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | ubiquitin specific peptidase 2 | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 3, subfamily A, polypeptide 4 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Plasmodium falciparum | ubiquitin specific protease, putative | ubiquitin specific peptidase 2 | 362 aa | 378 aa | 25.7 % |
Brugia malayi | cytochrome P450 | cytochrome P450, family 3, subfamily A, polypeptide 4 | 502 aa | 492 aa | 24.2 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | eukaryotic translation initiation factor 4h | 0.0132 | 0.3705 | 0.7851 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0044 | 0.0916 | 0.0916 |
Loa Loa (eye worm) | hypothetical protein | 0.0132 | 0.3705 | 0.5408 |
Echinococcus granulosus | survival motor neuron protein 1 | 0.0232 | 0.6851 | 0.6851 |
Schistosoma mansoni | ubiquitin-specific peptidase 8 (C19 family) | 0.0045 | 0.0924 | 0.1959 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0045 | 0.0924 | 0.5 |
Echinococcus multilocularis | guanine nucleotide binding protein G(s) subunit | 0.0044 | 0.0916 | 0.0916 |
Toxoplasma gondii | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.5 |
Schistosoma mansoni | ubiquitin-specific peptidase 2 (C19 family) | 0.0045 | 0.0924 | 0.1959 |
Mycobacterium tuberculosis | Probable aldehyde dehydrogenase | 0.006 | 0.1395 | 0.5 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0044 | 0.0916 | 0.1942 |
Trichomonas vaginalis | Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase | 0.0045 | 0.0924 | 0.5 |
Entamoeba histolytica | ubiquitin carboxyl-terminal hydrolase domain containing protein | 0.0045 | 0.0924 | 0.5 |
Echinococcus multilocularis | geminin | 0.0165 | 0.4719 | 0.4719 |
Echinococcus multilocularis | Peptidase C19, ubiquitin carboxyl terminal hydrolase 2 | 0.0045 | 0.0924 | 0.0924 |
Loa Loa (eye worm) | hypothetical protein | 0.0048 | 0.1046 | 0.1526 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.1058 | 0.1544 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0044 | 0.0916 | 0.0916 |
Mycobacterium ulcerans | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.5 |
Giardia lamblia | Ubiquitin carboxyl-terminal hydrolase 4 | 0.0045 | 0.0924 | 0.5 |
Mycobacterium ulcerans | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.5 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0044 | 0.0916 | 0.1942 |
Schistosoma mansoni | hypothetical protein | 0.0047 | 0.1008 | 0.2135 |
Trypanosoma cruzi | ubiquitin carboxyl-terminal hydrolase, putative | 0.0045 | 0.0924 | 0.5 |
Echinococcus multilocularis | ubiquitin carboxyl terminal hydrolase 8 | 0.0045 | 0.0924 | 0.0924 |
Leishmania major | aldehyde dehydrogenase, mitochondrial precursor | 0.006 | 0.1395 | 1 |
Echinococcus granulosus | aldehyde dehydrogenase mitochondrial | 0.006 | 0.1395 | 0.1395 |
Loa Loa (eye worm) | hypothetical protein | 0.0045 | 0.0924 | 0.1349 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.0049 | 0.1058 | 0.1544 |
Schistosoma mansoni | hypothetical protein | 0.0033 | 0.0568 | 0.1204 |
Echinococcus multilocularis | ubiquitin specific protease 41 | 0.0045 | 0.0924 | 0.0924 |
Schistosoma mansoni | Guanine nucleotide-binding protein G(s) subunit alpha (Adenylate cyclase-stimulating G alpha protein) | 0.0044 | 0.0916 | 0.1942 |
Echinococcus granulosus | guanine nucleotide binding protein Gs subunit | 0.0044 | 0.0916 | 0.0916 |
Echinococcus granulosus | Peptidase C19 ubiquitin carboxyl terminal hydrolase 2 | 0.0045 | 0.0924 | 0.0924 |
Loa Loa (eye worm) | hypothetical protein | 0.0232 | 0.6851 | 1 |
Echinococcus multilocularis | aldehyde dehydrogenase, mitochondrial | 0.006 | 0.1395 | 0.1395 |
Brugia malayi | latrophilin 2 splice variant baaae | 0.0033 | 0.0568 | 0.0829 |
Trypanosoma brucei | ubiquitin carboxyl-terminal hydrolase, putative | 0.0045 | 0.0924 | 0.5 |
Schistosoma mansoni | eukaryotic translation initiation factor 4h | 0.0132 | 0.3705 | 0.7851 |
Loa Loa (eye worm) | hypothetical protein | 0.0033 | 0.0568 | 0.0829 |
Schistosoma mansoni | survival motor neuron protein | 0.0047 | 0.1008 | 0.2135 |
Schistosoma mansoni | hypothetical protein | 0.0165 | 0.4719 | 1 |
Trichomonas vaginalis | Clan CA, family C19, ubiquitin hydrolase-like cysteine peptidase | 0.0045 | 0.0924 | 0.5 |
Echinococcus multilocularis | survival motor neuron protein 1 | 0.0232 | 0.6851 | 0.6851 |
Trypanosoma cruzi | ubiquitin carboxyl-terminal hydrolase, putative | 0.0045 | 0.0924 | 0.5 |
Schistosoma mansoni | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.2957 |
Schistosoma mansoni | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.2957 |
Onchocerca volvulus | 0.0048 | 0.1046 | 1 | |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.0049 | 0.1058 | 0.1544 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.0049 | 0.1058 | 0.1544 |
Schistosoma mansoni | hypothetical protein | 0.0165 | 0.4719 | 1 |
Echinococcus multilocularis | Eukaryotic translation initiation factor 4H | 0.0132 | 0.3705 | 0.3705 |
Echinococcus granulosus | ubiquitin specific protease 41 | 0.0045 | 0.0924 | 0.0924 |
Brugia malayi | Ubiquitin carboxyl-terminal hydrolase family protein | 0.0045 | 0.0924 | 0.1349 |
Echinococcus granulosus | Eukaryotic translation initiation factor 4H | 0.0132 | 0.3705 | 0.3705 |
Loa Loa (eye worm) | GTP-binding regulatory protein Gs alpha-S chain | 0.0044 | 0.0916 | 0.1338 |
Brugia malayi | GTP-binding regulatory protein Gs alpha-S chain, putative | 0.0044 | 0.0916 | 0.1338 |
Schistosoma mansoni | cellular tumor antigen P53 | 0.0048 | 0.1046 | 0.2216 |
Brugia malayi | hypothetical protein | 0.0232 | 0.6851 | 1 |
Mycobacterium ulcerans | aldehyde dehydrogenase | 0.006 | 0.1395 | 0.5 |
Schistosoma mansoni | eukaryotic translation initiation factor 4h | 0.0132 | 0.3705 | 0.7851 |
Echinococcus granulosus | geminin | 0.0165 | 0.4719 | 0.4719 |
Echinococcus granulosus | ubiquitin carboxyl terminal hydrolase 8 | 0.0045 | 0.0924 | 0.0924 |
Brugia malayi | Iron-sulfur cluster assembly accessory protein | 0.0047 | 0.1008 | 0.1471 |
Brugia malayi | RNA binding protein | 0.0132 | 0.3705 | 0.5408 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2d6 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c9 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp1a2 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp2c19 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | = 12.58925412 uM | PUBCHEM_BIOASSAY: Cytochrome panel assay with activity outcomes. (Class of assay: other) Panel member name: p450-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference |
Potency (functional) | = 12.5893 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Ubiquitin-specific Protease USP2a. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (ADMET) | = 12.5893 um | PUBCHEM_BIOASSAY: qHTS Assay for Activators of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] | ChEMBL. | No reference |
Potency (ADMET) | = 12.5893 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 3A4. (Class of assay: confirmatory) [Related pubchem assays: 410 ] | ChEMBL. | No reference |
Potency (functional) | = 28.1838 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Aldehyde Dehydrogenase 1 (ALDH1A1). (Class of assay: confirmatory) [Related pubchem assays: 1030 (qHTS Validation Assay for Inhibitors of aldehyde dehydrogenase 1 (ALDH1A1))] | 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.