Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | cytochrome P450, family 2, subfamily D, polypeptide 6 | Starlite/ChEMBL | No references |
Homo sapiens | cytochrome P450, family 1, subfamily A, polypeptide 2 | Starlite/ChEMBL | No references |
Homo sapiens | arachidonate 15-lipoxygenase | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Cytochrome P450 family protein | cytochrome P450, family 1, subfamily A, polypeptide 2 | 516 aa | 470 aa | 26.2 % |
Echinococcus granulosus | arachidonate 5 lipoxygenase | arachidonate 15-lipoxygenase | 662 aa | 590 aa | 23.9 % |
Brugia malayi | cytochrome P450 | cytochrome P450, family 2, subfamily D, polypeptide 6 | 497 aa | 425 aa | 32.0 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | jumonji/arid domain-containing protein | 0.0035 | 0.0153 | 0.0144 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.0049 | 0.0494 | 0.0485 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0494 | 0.0485 |
Echinococcus granulosus | jumonji domain containing protein | 0.004 | 0.0277 | 0.0277 |
Echinococcus multilocularis | histone lysine N methyltransferase SETMAR | 0.0029 | 0.0026 | 0.0016 |
Loa Loa (eye worm) | hypothetical protein | 0.0029 | 0.0026 | 0.0016 |
Brugia malayi | jmjC domain containing protein | 0.0035 | 0.0153 | 0.034 |
Loa Loa (eye worm) | hypothetical protein | 0.0049 | 0.0497 | 0.0488 |
Echinococcus granulosus | arachidonate 5 lipoxygenase | 0.0067 | 0.0909 | 0.0909 |
Schistosoma mansoni | leukotriene A4 hydrolase (M01 family) | 0.045 | 1 | 1 |
Schistosoma mansoni | histone-lysine n-methyltransferase suv9 | 0.0029 | 0.0026 | 0.0016 |
Echinococcus granulosus | PHD finger protein rhinoceros | 0.0029 | 0.0009 | 0.0009 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.0049 | 0.0494 | 0.1147 |
Echinococcus multilocularis | histone lysine methyltransferase setb histone lysine methyltransferase eggless | 0.0029 | 0.0026 | 0.0016 |
Echinococcus multilocularis | lysine specific demethylase 5A | 0.0035 | 0.0153 | 0.0144 |
Toxoplasma gondii | histone lysine methyltransferase SET/SUV39 | 0.0029 | 0.0026 | 1 |
Schistosoma mansoni | histone-lysine n-methyltransferase setb1 | 0.0029 | 0.0026 | 0.0016 |
Schistosoma mansoni | hypothetical protein | 0.0034 | 0.0125 | 0.0115 |
Loa Loa (eye worm) | hypothetical protein | 0.0034 | 0.0125 | 0.0115 |
Schistosoma mansoni | lipoxygenase | 0.0067 | 0.0909 | 0.09 |
Onchocerca volvulus | 0.0029 | 0.0026 | 0.0034 | |
Loa Loa (eye worm) | jmjC domain-containing protein | 0.0035 | 0.0153 | 0.0144 |
Echinococcus multilocularis | jumonji domain containing protein | 0.004 | 0.0277 | 0.0267 |
Trichomonas vaginalis | set domain proteins, putative | 0.0234 | 0.4871 | 0.5 |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.0049 | 0.0494 | 0.1147 |
Plasmodium vivax | SET domain protein, putative | 0.0029 | 0.0026 | 1 |
Plasmodium falciparum | phd finger protein, putative | 0.0029 | 0.0009 | 0.5 |
Loa Loa (eye worm) | pre-SET domain-containing protein family protein | 0.0205 | 0.4198 | 0.4192 |
Brugia malayi | hypothetical protein | 0.0207 | 0.4234 | 1 |
Brugia malayi | Pre-SET motif family protein | 0.0205 | 0.4198 | 0.9914 |
Onchocerca volvulus | 0.0234 | 0.4871 | 1 | |
Brugia malayi | Pre-SET motif family protein | 0.0029 | 0.0026 | 0.0039 |
Echinococcus multilocularis | Transcription factor, JmjC domain containing protein | 0.0094 | 0.1562 | 0.1554 |
Echinococcus multilocularis | leukotriene A 4 hydrolase | 0.045 | 1 | 1 |
Echinococcus granulosus | histone lysine methyltransferase setb | 0.0029 | 0.0026 | 0.0026 |
Loa Loa (eye worm) | jmjC domain-containing protein | 0.0059 | 0.0736 | 0.0727 |
Brugia malayi | latrophilin 2 splice variant baaae | 0.0034 | 0.0125 | 0.0273 |
Schistosoma mansoni | jumonji domain containing protein | 0.0075 | 0.1102 | 0.1094 |
Echinococcus multilocularis | arachidonate 5 lipoxygenase | 0.0067 | 0.0909 | 0.09 |
Echinococcus granulosus | lysine specific demethylase 5A | 0.0035 | 0.0153 | 0.0153 |
Echinococcus granulosus | Transcription factor JmjC domain containing protein | 0.0094 | 0.1562 | 0.1562 |
Schistosoma mansoni | jumonji/arid domain-containing protein | 0.0035 | 0.0153 | 0.0144 |
Loa Loa (eye worm) | leukotriene A4 hydrolase | 0.045 | 1 | 1 |
Schistosoma mansoni | histone-lysine n-methyltransferase setb1 | 0.0029 | 0.0026 | 0.0016 |
Brugia malayi | jmjC domain containing protein | 0.0094 | 0.1562 | 0.3675 |
Giardia lamblia | PHD finger protein 15 | 0.0029 | 0.0009 | 0.5 |
Schistosoma mansoni | histone-lysine n-methyltransferase setb1 | 0.0029 | 0.0026 | 0.0016 |
Echinococcus granulosus | peregrin | 0.0029 | 0.0009 | 0.0009 |
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-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-cyp2c19 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-cyp3a4 Compounds with AC50 equal or less than 10 uM are considered active | ChEMBL. | No reference | |
AC50 (functional) | = 15.84893192 uM | 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) | = 15.84893192 uM | 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 |
Potency (functional) | = 0.5012 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of 15-hLO (15-human lipoxygenase). (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (ADMET) | = 15.8489 um | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors and Substrates of Cytochrome P450 2D6. (Class of assay: confirmatory) [Related pubchem assays: 410 ] | 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.