Species | Target name | Source | Bibliographic reference |
---|---|---|---|
Homo sapiens | geminin, DNA replication inhibitor | Starlite/ChEMBL | No references |
Escherichia coli | penicillin-binding protein | Starlite/ChEMBL | No references |
Homo sapiens | GNAS complex locus | 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 % |
Schistosoma mansoni | GTP-binding protein alpha subunit gna | GNAS complex locus | 394 aa | 450 aa | 28.7 % |
Species | Potential target | Raw | Global | Species |
---|---|---|---|---|
Trichomonas vaginalis | spcc417.12 protein, putative | 0.0194 | 0 | 0.5 |
Mycobacterium ulcerans | carboxylesterase, LipT | 0.0194 | 0 | 0.5 |
Echinococcus multilocularis | geminin | 0.0205 | 0.0109 | 0.0109 |
Echinococcus multilocularis | fatty acid amide hydrolase 1 | 0.0442 | 0.2593 | 0.2593 |
Schistosoma mansoni | hypothetical protein | 0.0205 | 0.0109 | 0.0109 |
Onchocerca volvulus | 0.0194 | 0 | 0.5 | |
Echinococcus granulosus | fatty acid amide hydrolase 1 | 0.0442 | 0.2593 | 0.2593 |
Echinococcus granulosus | geminin | 0.0205 | 0.0109 | 0.0109 |
Schistosoma mansoni | fatty-acid amide hydrolase | 0.0442 | 0.2593 | 0.2593 |
Schistosoma mansoni | hypothetical protein | 0.0205 | 0.0109 | 0.0109 |
Schistosoma mansoni | amidase | 0.0442 | 0.2593 | 0.2593 |
Brugia malayi | amidase | 0.0442 | 0.2593 | 0.2593 |
Loa Loa (eye worm) | hypothetical protein | 0.1149 | 1 | 1 |
Mycobacterium tuberculosis | Possible penicillin-binding protein | 0.0278 | 0.0875 | 1 |
Onchocerca volvulus | 0.0194 | 0 | 0.5 | |
Trichomonas vaginalis | carboxylesterase domain containing protein, putative | 0.0194 | 0 | 0.5 |
Loa Loa (eye worm) | hypothetical protein | 0.0442 | 0.2593 | 0.2593 |
Brugia malayi | Carboxylesterase family protein | 0.1149 | 1 | 1 |
Echinococcus multilocularis | fatty acid amide hydrolase 1 | 0.0442 | 0.2593 | 0.2593 |
Onchocerca volvulus | 0.0194 | 0 | 0.5 | |
Echinococcus multilocularis | acetylcholinesterase | 0.1149 | 1 | 1 |
Loa Loa (eye worm) | acetylcholinesterase 1 | 0.1149 | 1 | 1 |
Onchocerca volvulus | 0.0194 | 0 | 0.5 | |
Schistosoma mansoni | family S9 non-peptidase homologue (S09 family) | 0.1149 | 1 | 1 |
Onchocerca volvulus | 0.0194 | 0 | 0.5 | |
Loa Loa (eye worm) | hypothetical protein | 0.1149 | 1 | 1 |
Echinococcus granulosus | fatty acid amide hydrolase 1 | 0.0442 | 0.2593 | 0.2593 |
Echinococcus granulosus | acetylcholinesterase | 0.1149 | 1 | 1 |
Echinococcus granulosus | carboxylesterase 5A | 0.1149 | 1 | 1 |
Echinococcus multilocularis | acetylcholinesterase | 0.1149 | 1 | 1 |
Echinococcus granulosus | acetylcholinesterase | 0.1149 | 1 | 1 |
Echinococcus multilocularis | carboxylesterase 5A | 0.1149 | 1 | 1 |
Loa Loa (eye worm) | carboxylesterase | 0.1149 | 1 | 1 |
Activity type | Activity value | Assay description | Source | Reference |
---|---|---|---|---|
Potency (functional) | 0.3663 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) | = 0.631 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) | 0.7943 uM | PubChem BioAssay. qHTS for Agonist of gsp, the Etiologic Mutation Responsible for Fibrous Dysplasia/McCune-Albright Syndrome: qHTS. (Class of assay: confirmatory) | ChEMBL. | No reference |
Potency (functional) | 18.526 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) | 18.526 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 |
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.