Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | hexokinase domain containing 1 | Starlite/ChEMBL | No references |
Homo sapiens | glucagon-like peptide 1 receptor | Starlite/ChEMBL | No references |
Homo sapiens | muscleblind-like splicing regulator 1 | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Loa Loa (eye worm) | pigment dispersing factor receptor c | glucagon-like peptide 1 receptor | 463 aa | 388 aa | 25.8 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Brugia malayi | Hexokinase family protein | 0.006 | 0.1378 | 0.1378 |
Brugia malayi | Calcitonin receptor-like protein seb-1 | 0.006 | 0.1368 | 0.1368 |
Plasmodium falciparum | hexokinase | 0.0096 | 0.3952 | 0.5 |
Brugia malayi | Hexokinase family protein | 0.0096 | 0.3952 | 0.3952 |
Trypanosoma brucei | hexokinase | 0.0096 | 0.3952 | 0.5 |
Leishmania major | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Toxoplasma gondii | hexokinase | 0.0096 | 0.3952 | 0.5 |
Onchocerca volvulus | 0.0096 | 0.3952 | 1 | |
Plasmodium vivax | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.018 | 1 | 1 |
Schistosoma mansoni | hexokinase | 0.0096 | 0.3952 | 1 |
Onchocerca volvulus | 0.0096 | 0.3952 | 1 | |
Trypanosoma cruzi | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Echinococcus multilocularis | muscleblind protein | 0.018 | 1 | 1 |
Loa Loa (eye worm) | hexokinase | 0.0096 | 0.3952 | 0.3952 |
Trypanosoma brucei | hexokinase | 0.0096 | 0.3952 | 0.5 |
Trypanosoma brucei | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Loa Loa (eye worm) | hexokinase type II | 0.0096 | 0.3952 | 0.3952 |
Leishmania major | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Treponema pallidum | hexokinase (hxk) | 0.0096 | 0.3952 | 0.5 |
Loa Loa (eye worm) | pigment dispersing factor receptor c | 0.006 | 0.1368 | 0.1368 |
Brugia malayi | Corticotropin releasing factor receptor 2 precursor, putative | 0.006 | 0.1368 | 0.1368 |
Loa Loa (eye worm) | hypothetical protein | 0.0066 | 0.1756 | 0.1756 |
Loa Loa (eye worm) | hypothetical protein | 0.018 | 1 | 1 |
Echinococcus multilocularis | muscleblind protein 1 | 0.018 | 1 | 1 |
Echinococcus granulosus | muscleblind protein | 0.018 | 1 | 1 |
Brugia malayi | hexokinase | 0.0096 | 0.3952 | 0.3952 |
Entamoeba histolytica | hexokinase 2 | 0.0096 | 0.3952 | 0.5 |
Loa Loa (eye worm) | hexokinase | 0.006 | 0.1378 | 0.1378 |
Loa Loa (eye worm) | hexokinase | 0.0096 | 0.3952 | 0.3952 |
Loa Loa (eye worm) | hypothetical protein | 0.006 | 0.1368 | 0.1368 |
Onchocerca volvulus | 0.0096 | 0.3952 | 1 | |
Trypanosoma cruzi | hexokinase, putative | 0.0096 | 0.3952 | 0.5 |
Entamoeba histolytica | hexokinase 1 | 0.0096 | 0.3952 | 0.5 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
IC50 (functional) | = 9.55 uM | PUBCHEM_BIOASSAY: Dose Response confirmation of inhibitors of hexokinase domain containing I (HKDC1). (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493160, AID493190] | ChEMBL. | No reference |
IC50 (functional) | = 12.9 uM | PUBCHEM_BIOASSAY: Dose Response confirmation of inhibitors of hexokinase domain containing I (HKDC1) in the hexokinase 1 selectivity assay. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID493160, AID493190] | ChEMBL. | No reference |
Potency (functional) | 10.4179 uM | PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 48 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488752, AID488774, AID504848, AID504850] | ChEMBL. | No reference |
Potency (functional) | 11.2202 uM | PubChem BioAssay. qHTS of GLP-1 Receptor Inverse Agonists (Inhibition Mode). (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (binding) | 15.8489 uM | PubChem BioAssay. qHTS Assay for Inhibitors of MBNL1-poly(CUG) RNA binding. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 22.3872 uM | PUBCHEM_BIOASSAY: Inhibitors of TCP-1 ring complex (TRiC) of Methanococcus maripaludis (MmCpn): qHTS. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488991] | ChEMBL. | No reference |
Potency (functional) | 25.1189 uM | PUBCHEM_BIOASSAY: qHTS for Inhibitors of TGF-b. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID588856, AID588860] | ChEMBL. | No reference |
Potency (functional) | 25.929 uM | PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in MCF 10a normal breast cells. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 100 uM | PUBCHEM_BIOASSAY: HTS for Inhibitors of HP1-beta Chromodomain Interactions with Methylated Histone Tails. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488962] | ChEMBL. | No reference |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Plasmodium falciparum | ChEMBL23 |
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.