Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NUDT1 | P36639 | 7/20 | 0.41 |
| ▸ | TYK2 | P29597 | 1/20 | 0.35 |
| ▸ | BPTF | Q12830 | 1/20 | 0.35 |
| ▸ | PDPK1 | O15530 | 5/20 | 0.34 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.34 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.34 |
| ▸ | GSK3B | P49841 | 2/20 | 0.34 |
| ▸ | CDC7 | O00311 | 1/20 | 0.34 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.34 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.34 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.34 |
| ▸ | PAK4 | O96013 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | PRKACA | P17612 | 1/20 | 0.34 |
| ▸ | GRK5 | P34947 | 1/20 | 0.34 |
| ▸ | MAP2K2 | P36507 | 1/20 | 0.34 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.34 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.34 |
| ▸ | CDK8 | P49336 | 1/20 | 0.34 |
| ▸ | CLK2 | P49760 | 1/20 | 0.34 |
Click a target to see other patent compounds predicted against it — the reverse direction, in place.
Similar compounds — the chemically nearest patent molecules
Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.
| Compound | similarity | top predicted | shared targets | |
|---|---|---|---|---|
| SCHEMBL20620223 | 0.85 | NUDT1 (0.44) | NUDT1PDPK1ROCK1DYRK1AAURKA | |
| SCHEMBL17325525 | 0.85 | NUDT1 (0.44) | NUDT1PDPK1ROCK1DYRK1AAURKA | |
| SCHEMBL20620222 | 0.81 | DYRK1A (0.50) | NUDT1TYK2BPTFPDPK1ROCK1 | |
| SCHEMBL15757624 | 0.76 | HTR6 (0.44) | NUDT1TYK2BPTFCDK8 | |
| SCHEMBL17325627 | 0.76 | AGPAT2 (0.40) | NUDT1PDPK1ROCK1AURKATGFBR1 | |
| SCHEMBL15757681 | 0.69 | BPTF (0.67) | NUDT1BPTFPDPK1ROCK1DYRK1A | |
| SCHEMBL21317804 | 0.67 | ELANE (0.39) | TGFBR1 | |
| SCHEMBL17325531 | 0.67 | NUDT1 (0.44) | NUDT1PDPK1ROCK1AURKATGFBR1 | |
| SCHEMBL3354801 | 0.67 | AKT1 (0.37) | GSK3BPIM1ALKAURKATGFBR1 | |
| SCHEMBL15757522 | 0.66 | GPR39 (0.54) | NUDT1PDPK1ROCK1AURKATGFBR1 |
Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.
Patent provenance — the patents this molecule appears in, and who filed them
Claimed or disclosed in 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2015187089-A1 | MTH1 INHIBITORS FOR TREATMENT OF INFLAMMATORY AND AUTOIMMUNE CONDITIONS | THOMAS HELLEDAYS STIFTELSE FÖR MEDICINSK FORSKNING (SE) | 2015-12-10 | — | — | WO | disclosed |