Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.75 |
| ▸ | CDC25B | P30305 | 1/20 | 0.75 |
| ▸ | CASP6 | P55212 | 1/20 | 0.75 |
| ▸ | RCE1 | Q9Y256 | 1/20 | 0.75 |
| ▸ | KDM4E | B2RXH2 | 4/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.59 |
| ▸ | GFER | P55789 | 1/20 | 0.59 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.59 |
| ▸ | MAPT | P10636 | 3/20 | 0.57 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.57 |
| ▸ | MCL1 | Q07820 | 2/20 | 0.57 |
| ▸ | MEN1 | O00255 | 2/20 | 0.57 |
| ▸ | THRB | P10828 | 2/20 | 0.57 |
| ▸ | RECQL | P46063 | 2/20 | 0.57 |
| ▸ | USP2 | O75604 | 1/20 | 0.57 |
| ▸ | POLB | P06746 | 1/20 | 0.57 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | APEX1 | P27695 | 1/20 | 0.57 |
| ▸ | BLM | P54132 | 1/20 | 0.57 |
| ▸ | GLA | P06280 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL25170829 | 0.86 | ALDH1A1 (0.78) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL29832194 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL29861837 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL30291197 | 0.86 | ALDH1A1 (0.78) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL107442 | 0.86 | ALDH1A1 (1.00) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL19419446 | 0.84 | ALDH1A1 (0.75) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| Phosphine SCHEMBL21753935 | 0.84 | ALDH1A1 (0.96) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL9349442 | 0.84 | ALDH1A1 (0.53) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| Ammonia Solution, Strong SCHEMBL8509203 | 0.84 | ALDH1A1 (0.96) | ALDH1A1CDC25BCASP6RCE1KDM4E | |
| SCHEMBL27663595 | 0.84 | ALDH1A1 (0.53) | ALDH1A1CDC25BCASP6RCE1KDM4E |
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-2008115381-A1 | PYRIDAZINONE DERIVATIVES USEFUL AS GLUCAN SYNTHASE INHIBITORS | SCHERING CORPORATION (US) | 2008-09-25 | — | — | WO | disclosed |