Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BACE1 | P56817 | 4/20 | 0.46 |
| ▸ | CDC25B | P30305 | 3/20 | 0.45 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.45 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.45 |
| ▸ | HBB | P68871 | 2/20 | 0.45 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.45 |
| ▸ | IDO1 | P14902 | 2/20 | 0.45 |
| ▸ | CDC25A | P30304 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.45 |
| ▸ | MEN1 | O00255 | 1/20 | 0.45 |
| ▸ | PLIN1 | O60240 | 1/20 | 0.45 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.45 |
| ▸ | USP2 | O75604 | 1/20 | 0.45 |
| ▸ | GSR | P00390 | 1/20 | 0.45 |
| ▸ | LMNA | P02545 | 1/20 | 0.45 |
| ▸ | TP53 | P04637 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL29424584 | 0.86 | BACE1 (0.56) | BACE1CDC25BALDH1A1CYP3A4MAPK1 | |
| SCHEMBL30580334 | 0.73 | ALDH1A1 (0.66) | CDC25BALDH1A1CYP3A4MAPK1HBB | |
| SCHEMBL224650 | 0.73 | ALDH1A1 (0.66) | CDC25BALDH1A1CYP3A4MAPK1HBB | |
| SCHEMBL2265203 | 0.73 | CA1 (0.47) | CDC25BALDH1A1CYP3A4MAPK1HBB | |
| SCHEMBL22411120 | 0.71 | MAPT (0.53) | BACE1CDC25BALDH1A1CYP3A4MAPK1 | |
| SCHEMBL1688847 | 0.71 | ALDH1A1 (0.55) | ALDH1A1CYP3A4MAPK1HBBSMN1; SMN2 | |
| SCHEMBL6555840 | 0.71 | BACE1 (0.75) | BACE1CDC25BALDH1A1CYP3A4MAPK1 | |
| SCHEMBL3976848 | 0.69 | SMN1; SMN2 (0.55) | CDC25BALDH1A1CYP3A4MAPK1HBB | |
| SCHEMBL29392682 | 0.69 | ALDH1A1 (0.60) | CDC25BALDH1A1CYP3A4MAPK1HBB | |
| SCHEMBL14852073 | 0.69 | PTPRC (0.63) | CDC25BALDH1A1CYP3A4MAPK1HBB |
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-2011044375-A2 | APOGOSSYPOLONE DERIVATIVES AS ANTICANCER AGENTS | SANFORD-BURNHAM MEDICAL RESEARCH INSTITUTE (US) | 2011-04-14 | — | — | WO | disclosed |