Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.58 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.55 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.51 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.51 |
| ▸ | NPC1 | O15118 | 1/20 | 0.51 |
| ▸ | AKR1C3 | P42330 | 1/20 | 0.47 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.47 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.47 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.47 |
| ▸ | RPS6KA5 | O75582 | 1/20 | 0.47 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.47 |
| ▸ | CDK1 | P06493 | 1/20 | 0.47 |
| ▸ | CSF1R | P07333 | 1/20 | 0.47 |
| ▸ | PRKACA | P17612 | 1/20 | 0.47 |
| ▸ | FLT1 | P17948 | 1/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.47 |
| ▸ | CDK2 | P24941 | 1/20 | 0.47 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.47 |
| ▸ | AKT1 | P31749 | 1/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL8317390 | 0.89 | TDP1 (0.61) | TDP1ALDH1A1LMNASMN1; SMN2NPC1 | |
| SCHEMBL8303241 | 0.83 | PKM (0.46) | PKMTDP1ALDH1A1LMNAL3MBTL1 | |
| SCHEMBL8428817 | 0.82 | PKM (0.50) | PKMALDH1A1LMNANPC1AKR1C3 | |
| SCHEMBL8317458 | 0.79 | PKM (0.49) | PKMTDP1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL8571576 | 0.78 | RXRA (0.66) | PKMTDP1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL28421135 | 0.78 | RXRA (0.66) | PKMTDP1ALDH1A1LMNASMN1; SMN2 | |
| SCHEMBL751213 | 0.78 | ALDH1A1 (0.77) | TDP1ALDH1A1LMNASMN1; SMN2NPC1 | |
| SCHEMBL1101522 | 0.78 | ALDH1A1 (0.77) | TDP1ALDH1A1LMNASMN1; SMN2NPC1 | |
| SCHEMBL5968858 | 0.78 | ALDH1A1 (0.77) | TDP1ALDH1A1LMNASMN1; SMN2NPC1 | |
| SCHEMBL2420009 | 0.77 | ALDH1A1 (0.62) | ALDH1A1LMNASMN1; SMN2NPC1ROCK2 |
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-2004071401-A2 | HYDROXAMIC ACID DERIVATIVES AS HISTONE DEACETYLASE INHIBITORS (HDCA) | FUJISAWA PHARMACEUTICAL CO., LTD. (JP) | 2004-08-26 | — | — | WO | disclosed |