Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ATAD2 | Q6PL18 | 1/20 | 0.38 |
| ▸ | PARP1 | P09874 | 1/20 | 0.34 |
| ▸ | TYMS | P04818 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL12820951 | 0.79 | DYRK1A (0.46) | TYMS | |
| SCHEMBL4404082 | 0.72 | POLB (0.56) | PARP1 | |
| SCHEMBL7013187 | 0.68 | CYP1A2 (0.56) | ATAD2PARP1 | |
| SCHEMBL1520734 | 0.67 | ALDH1A1 (0.50) | — | |
| SCHEMBL14197939 | 0.66 | — | — | |
| SCHEMBL14483843 | 0.65 | — | — | |
| SCHEMBL7851196 | 0.64 | TYMS (0.48) | PARP1TYMS | |
| SCHEMBL26232177 | 0.63 | TYMS (0.41) | PARP1TYMS | |
| SCHEMBL10307717 | 0.63 | DYRK1A (0.38) | — | |
| SCHEMBL25951466 | 0.63 | ALDH1A1 (0.42) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0733633-B1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES LTD (JP) | 2003-05-28 | — | — | EP | disclosed |
| EP-0733633-A1 | Heterocyclic compounds, their production and use | TAKEDA CHEMICAL INDUSTRIES, LTD. (JP) | 1996-09-25 | — | — | EP | disclosed |