Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.47 |
| ▸ | CYP1A2 | P05177 | 3/20 | 0.44 |
| ▸ | CYP2A6 | P11509 | 3/20 | 0.44 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.44 |
| ▸ | HPGD | P15428 | 3/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.44 |
| ▸ | LMNA | P02545 | 1/20 | 0.44 |
| ▸ | MAOB | P27338 | 5/20 | 0.40 |
| ▸ | SIRT2 | Q8IXJ6 | 5/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.39 |
| ▸ | MEN1 | O00255 | 1/20 | 0.39 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.38 |
| ▸ | CA12 | O43570 | 1/20 | 0.37 |
| ▸ | CA1 | P00915 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL18327969 | 0.92 | ALDH1A1 (0.47) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL31026604 | 0.90 | ALDH1A1 (0.52) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL24029539 | 0.84 | TDP1 (0.47) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL27360805 | 0.83 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL10109875 | 0.80 | L3MBTL1 (0.47) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL18327949 | 0.80 | ALDH1A1 (0.46) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL25492898 | 0.79 | MAOB (0.40) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL9779121 | 0.78 | CYP1A2 (0.48) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL13562105 | 0.78 | CYP2A6 (0.46) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD | |
| SCHEMBL13562162 | 0.78 | MAOB (0.42) | ALDH1A1CYP1A2CYP2A6KDM4EHPGD |
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 |
|---|---|---|---|---|---|---|---|
| US-9586972-B2 | Organic thin film transistor, organic semiconductor thin film, and organic semiconductor material | FUJIFILM CORPORATION (JP) | 2017-03-07 | — | — | US | disclosed |