Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 1/20 | 0.61 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.61 |
| ▸ | LMNA | P02545 | 2/20 | 0.56 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.56 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.56 |
| ▸ | THRB | P10828 | 1/20 | 0.56 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.56 |
| ▸ | ROCK2 | O75116 | 1/20 | 0.54 |
| ▸ | ROCK1 | Q13464 | 1/20 | 0.54 |
| ▸ | GAA | P10253 | 3/20 | 0.54 |
| ▸ | HTT | P42858 | 1/20 | 0.54 |
| ▸ | ALPL | P05186 | 1/20 | 0.54 |
| ▸ | ALPI | P09923 | 1/20 | 0.54 |
| ▸ | ALPG | P10696 | 1/20 | 0.54 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.54 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.54 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.52 |
| ▸ | MEN1 | O00255 | 1/20 | 0.52 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.52 |
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 | |
|---|---|---|---|---|
| SCHEMBL2488253 | 0.86 | HDAC1 (0.65) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| SCHEMBL2000041 | 0.85 | HDAC1 (0.74) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| SCHEMBL14507678 | 0.84 | KMO (0.60) | ALDH1A1KDM4EHTTKMT2A | |
| SCHEMBL25799425 | 0.83 | LMNA (0.61) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| SCHEMBL13767912 | 0.83 | HDAC1 (0.61) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| Nicotinyl Methylamide SCHEMBL30664356 | 0.82 | HDAC1 (0.69) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| Nicotinyl Methylamide SCHEMBL129458 | 0.82 | HDAC1 (0.69) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| Nicotinyl Methylamide SCHEMBL28560459 | 0.82 | HDAC1 (0.69) | HDAC1HDAC6LMNAALDH1A1KDM4E | |
| SCHEMBL14507336 | 0.81 | ALDH1A1 (0.63) | LMNAALDH1A1HIF1AHTTKMT2A | |
| SCHEMBL28712350 | 0.81 | ALDH1A1 (0.66) | HDAC1HDAC6LMNAALDH1A1KDM4E |
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-2018053096-A1 | METHOD OF INCREASING UPTAKE AND WASHFASTNESS OF HAIR HEALTH COMPOUNDS | THE PROCTER & GAMBLE COMPANY (US) | 2018-03-22 | — | — | WO | disclosed |