Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.55 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.46 |
| ▸ | MRGPRX4 | Q96LA9 | 1/20 | 0.46 |
| ▸ | BRD4 | O60885 | 1/20 | 0.46 |
| ▸ | PPM1D | O15297 | 2/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | NPC1 | O15118 | 1/20 | 0.44 |
| ▸ | RAB9A | P51151 | 1/20 | 0.44 |
| ▸ | ATM | Q13315 | 1/20 | 0.44 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CA2 | P00918 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 2/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | PKM | P14618 | 1/20 | 0.43 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.43 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL8041888 | 0.87 | ALDH1A1 (0.59) | ALDH1A1BRD4MAPTNPC1RAB9A | |
| SCHEMBL4535606 | 0.85 | ALDH1A1 (0.64) | ALDH1A1PPM1DMAPTNPC1RAB9A | |
| SCHEMBL8037982 | 0.83 | KDM4E (0.54) | ALDH1A1HIF1AMRGPRX4PPM1DMAPT | |
| SCHEMBL8037607 | 0.80 | ALDH1A1 (0.60) | ALDH1A1HIF1ABRD4MAPTNPC1 | |
| SCHEMBL8024498 | 0.80 | MAPT (0.53) | ALDH1A1MAPTNPC1RAB9AMEN1 | |
| SCHEMBL22469948 | 0.78 | MRGPRX4 (0.74) | HIF1AMRGPRX4PPM1DMAPTNPC1 | |
| SCHEMBL31237125 | 0.76 | MRGPRX4 (0.57) | ALDH1A1HIF1AMRGPRX4PPM1DMAPT | |
| SCHEMBL15761741 | 0.75 | HIF1A (0.65) | ALDH1A1HIF1AMRGPRX4MAPTNPC1 | |
| SCHEMBL9402456 | 0.74 | HDAC8 (0.69) | ALDH1A1HIF1AMAPTNPC1RAB9A | |
| SCHEMBL8033332 | 0.74 | MEN1 (0.54) | ALDH1A1MAPTNPC1RAB9AMEN1 |
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-2009083526-A1 | NOVEL COMPOUNDS | SMITHKLINE BEECHAM CORPORATION (US) | 2009-07-09 | — | — | WO | disclosed |