Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | STAT3 | P40763 | 6/20 | 0.60 |
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.60 |
| ▸ | BCL2 | P10415 | 1/20 | 0.37 |
| ▸ | MCL1 | Q07820 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.36 |
| ▸ | MEN1 | O00255 | 4/20 | 0.36 |
| ▸ | CDC25B | P30305 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 5/20 | 0.36 |
| ▸ | HTT | P42858 | 5/20 | 0.36 |
| ▸ | APAF1 | O14727 | 3/20 | 0.36 |
| ▸ | RAB9A | P51151 | 2/20 | 0.36 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.36 |
| ▸ | TTR | P02766 | 1/20 | 0.36 |
| ▸ | TDP1 | Q9NUW8 | 4/20 | 0.35 |
| ▸ | NPC1 | O15118 | 3/20 | 0.35 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.35 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | TSHR | P16473 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL18730820 | 0.84 | STAT3 (0.69) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL45662 | 0.79 | STAT3 (0.61) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL15006560 | 0.79 | STAT3 (0.61) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL12640087 | 0.79 | STAT3 (0.75) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL15024564 | 0.78 | STAT3 (0.56) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL45742 | 0.77 | STAT3 (0.58) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| Napabucasin SCHEMBL1883845 | 0.76 | STAT3 (1.00) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| Napabucasin SCHEMBL29349770 | 0.76 | STAT3 (1.00) | STAT3ALDH1A1BCL2MCL1KMT2A | |
| SCHEMBL6001021 | 0.75 | ALDH1A1 (0.69) | STAT3ALDH1A1KMT2AMEN1CDC25B | |
| SCHEMBL18730822 | 0.75 | STAT3 (0.63) | STAT3ALDH1A1BCL2MCL1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| EP-3153508-A1 | NOVEL ANTICANCER AGENT | Kyoto Pharmaceutical Industries, Ltd. (JP) | 2017-04-12 | — | — | EP | disclosed |