Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Escherichia coli | penicillin-binding protein | Starlite/ChEMBL | No references |
Homo sapiens | TAR DNA binding protein | Starlite/ChEMBL | No references |
Homo sapiens | geminin, DNA replication inhibitor | Starlite/ChEMBL | No references |
Species | Potential target | Known druggable target | Length | Alignment span | Identity |
---|---|---|---|---|---|
Brugia malayi | Hypothetical 65.5 kDa Trp-Asp repeats containing protein F02E8.5 inchromosome X | geminin, DNA replication inhibitor | 209 aa | 176 aa | 27.8 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Schistosoma mansoni | hypothetical protein | 0.0205 | 0.135 | 0.135 |
Echinococcus multilocularis | acetylcholinesterase | 0.0728 | 1 | 1 |
Schistosoma mansoni | hypothetical protein | 0.0205 | 0.135 | 0.135 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.0728 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0728 | 1 | 1 |
Loa Loa (eye worm) | hypothetical protein | 0.0728 | 1 | 1 |
Brugia malayi | Carboxylesterase family protein | 0.0728 | 1 | 1 |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.0728 | 1 | 1 |
Onchocerca volvulus | 0.0123 | 0 | 0.5 | |
Mycobacterium ulcerans | flavin-containing monoamine oxidase AofH | 0.0291 | 0.2781 | 1 |
Mycobacterium tuberculosis | Probable flavin-containing monoamine oxidase AofH (amine oxidase) (MAO) | 0.0271 | 0.2442 | 0.954 |
Trichomonas vaginalis | carboxylesterase domain containing protein, putative | 0.0123 | 0 | 0.5 |
Echinococcus multilocularis | carboxylesterase 5A | 0.0728 | 1 | 1 |
Onchocerca volvulus | 0.0123 | 0 | 0.5 | |
Mycobacterium tuberculosis | Possible penicillin-binding protein | 0.0278 | 0.2559 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.0728 | 1 | 1 |
Onchocerca volvulus | 0.0123 | 0 | 0.5 | |
Echinococcus granulosus | acetylcholinesterase | 0.0728 | 1 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.0728 | 1 | 1 |
Loa Loa (eye worm) | carboxylesterase | 0.0728 | 1 | 1 |
Onchocerca volvulus | 0.0123 | 0 | 0.5 | |
Trichomonas vaginalis | spcc417.12 protein, putative | 0.0123 | 0 | 0.5 |
Mycobacterium ulcerans | flavin-containing monoamine oxidase AofH | 0.0291 | 0.2781 | 1 |
Echinococcus granulosus | carboxylesterase 5A | 0.0728 | 1 | 1 |
Onchocerca volvulus | 0.0123 | 0 | 0.5 | |
Echinococcus granulosus | geminin | 0.0205 | 0.135 | 0.135 |
Echinococcus multilocularis | geminin | 0.0205 | 0.135 | 0.135 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Potency (functional) | 0.8199 uM | PubChem BioAssay. A quantitative high throughput screen for small molecules that induce DNA re-replication in SW480 colon adenocarcinoma cells. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 0.8913 uM | PUBCHEM_BIOASSAY: qHTS for Inhibitors of binding or entry into cells for Lassa Virus. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID463114, AID540249] | ChEMBL. | No reference |
Potency (functional) | 1.2589 uM | PubChem BioAssay. qHTS of TDP-43 Inhibitors. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | = 1.4125 um | PUBCHEM_BIOASSAY: qHTS Inhibitors of AmpC Beta-Lactamase (assay with detergent). (Class of assay: confirmatory) [Related pubchem assays: 1002 (Confirmation Concentration-Response Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent)), 585 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay without detergent) - a screen old NIH MLSMR collection), 584 (Promiscuous and Specific Inhibitors of AmpC Beta-Lactamase (assay with detergent) - a screen of the old NIH MLSMR collection), 1003 (Confirmation Cuvette-Based Assay for Inhibitors of AmpC Beta-Lactamase (assay with detergent))] | ChEMBL. | No reference |
Potency (functional) | 8.2753 uM | PUBCHEM_BIOASSAY: Primary qHTS for delayed death inhibitors of the malarial parasite plastid, 96 hour incubation. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID488745, AID488752, AID488774, AID504848, AID504850] | ChEMBL. | No reference |
Potency (functional) | 11.6891 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) | 89.1251 uM | PUBCHEM_BIOASSAY: qHTS Assay for Inhibitors of Histone Lysine Methyltransferase G9a. (Class of assay: confirmatory) [Related pubchem assays (depositor defined):AID504404] | ChEMBL. | No reference |
Species name | Source | Reference | Is orphan |
---|---|---|---|
Plasmodium falciparum | ChEMBL23 | ||
Homo sapiens | 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.