Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | p21 protein (Cdc42/Rac)-activated kinase 4 | Starlite/ChEMBL | No references |
Homo sapiens | p21 protein (Cdc42/Rac)-activated kinase 1 | Starlite/ChEMBL | No references |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Entamoeba histolytica | p21-activated kinase | 0.0064 | 0.1325 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0064 | 0.1288 | 0.1288 |
Trichomonas vaginalis | STE family protein kinase | 0.0064 | 0.1325 | 1 |
Entamoeba histolytica | protein kinase, putative | 0.0038 | 0.0037 | 0.0277 |
Giardia lamblia | Kinase, STE STE20 | 0.0064 | 0.1325 | 0.5 |
Trichomonas vaginalis | STE family protein kinase | 0.0064 | 0.1325 | 1 |
Trichomonas vaginalis | conserved hypothetical protein | 0.0064 | 0.1288 | 0.9715 |
Brugia malayi | Protein kinase domain | 0.0064 | 0.1325 | 0.1325 |
Echinococcus granulosus | serine:threonine protein kinase PAK 4 | 0.0202 | 0.8137 | 1 |
Trichomonas vaginalis | STE family protein kinase | 0.0064 | 0.1325 | 1 |
Echinococcus multilocularis | serine:threonine protein kinase PAK 3 | 0.0064 | 0.1325 | 0.1628 |
Echinococcus multilocularis | PAK box P21 Rho binding | 0.0038 | 0.0037 | 0.0045 |
Trichomonas vaginalis | STE family protein kinase | 0.0064 | 0.1325 | 1 |
Echinococcus granulosus | serine:threonine protein kinase PAK 3 | 0.0064 | 0.1325 | 0.1628 |
Entamoeba histolytica | protein kinase, putative | 0.0064 | 0.1325 | 1 |
Echinococcus multilocularis | serine:threonine protein kinase PAK 4 | 0.0202 | 0.8137 | 1 |
Schistosoma mansoni | protein kinase | 0.0038 | 0.0037 | 0.0277 |
Schistosoma mansoni | protein kinase | 0.0064 | 0.1325 | 1 |
Loa Loa (eye worm) | STE/STE20/PAKB protein kinase | 0.024 | 1 | 1 |
Echinococcus multilocularis | serine:threonine protein kinase PAK 3 | 0.0064 | 0.1325 | 0.1628 |
Echinococcus granulosus | p21 activated protein kinase 1 Dpak1 | 0.0064 | 0.1325 | 0.1628 |
Entamoeba histolytica | protein kinase, putative | 0.0038 | 0.0037 | 0.0277 |
Echinococcus granulosus | serine:threonine protein kinase PAK 3 | 0.0064 | 0.1325 | 0.1628 |
Echinococcus multilocularis | p21 activated protein kinase 1 Dpak1 | 0.0064 | 0.1325 | 0.1628 |
Schistosoma mansoni | protein kinase | 0.0064 | 0.1325 | 1 |
Entamoeba histolytica | protein kinase, putative | 0.0038 | 0.0037 | 0.0277 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Fu (ADMET) | = 11 % | Protein binding in human plasma assessed as unbound fraction | ChEMBL. | No reference |
IC50 (binding) | = 0.018 uM | Inhibition of human PAK1 kinase domain incubated for 120 mins using fluorescent 5-FAM-KPDRKKRYTVVGNPY-amide peptide substrate and ATP by caliper off-chip incubation mobility shift assay | ChEMBL. | No reference |
IC50 (binding) | = 0.55 uM | Inhibition of human PAK4 kinase domain incubated for 90 mins using fluorescent 5-FAM-Ahx-KKRNRRLSVA-amide peptide substrate and ATP by caliper off-chip incubation mobility shift assay | ChEMBL. | No reference |
IC50 (binding) | = 0.87 uM | Inhibition of PAK1 (unknown origin) expressed in cryopreserved human MCF10A cells assessed as reduction in enzyme phosphorylation at Ser144 residue | 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.