Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 2/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | KCNN4 | O15554 | 4/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.39 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.37 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.37 |
| ▸ | RIPK1 | Q13546 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL6050019 | 0.77 | CACNA1F (0.39) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL11044685 | 0.74 | CYP2D6 (0.46) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL22402881 | 0.74 | CYP2D6 (0.46) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL10590017 | 0.74 | ALDH1A1 (0.41) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL3079554 | 0.74 | CYP2D6 (0.46) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL3660630 | 0.72 | TAAR1 (0.48) | CYP2D6CYP1A2KCNN4MAPK1MAPT | |
| SCHEMBL575235 | 0.72 | MAPK1 (0.46) | CYP2D6CYP1A2KCNN4MAPK1MAPT | |
| SCHEMBL28516083 | 0.72 | MAPK1 (0.46) | CYP2D6CYP1A2KCNN4MAPK1MAPT | |
| SCHEMBL6050021 | 0.72 | KCNN4 (0.46) | CYP2D6CYP1A2KCNN4MAPK1ALDH1A1 | |
| SCHEMBL3088976 | 0.72 | MAPK1 (0.46) | CYP2D6CYP1A2KCNN4MAPK1MAPT |
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-1053990-A2 | A method of producing an aromatic ketone and an aromatic ketone composition containing it | TORAY INDUSTRIES, INC. (JP) | 2000-11-22 | — | — | EP | disclosed |