Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.50 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | POLB | P06746 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.37 |
| ▸ | PYGL | P06737 | 7/20 | 0.37 |
| ▸ | PYGM | P11217 | 5/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | XBP1 | P17861 | 1/20 | 0.35 |
| ▸ | ATM | Q13315 | 1/20 | 0.35 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.35 |
| ▸ | DUSP3 | P51452 | 1/20 | 0.34 |
| ▸ | PTPN5 | P54829 | 1/20 | 0.34 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.34 |
| ▸ | ESRRA | P11474 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL9847757 | 0.80 | ALDH1A1 (0.51) | ALDH1A1POLBKDM4ETDP1PYGL | |
| SCHEMBL5150318 | 0.80 | TP53 (0.52) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL16790543 | 0.78 | CYP2D6 (0.59) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL7965762 | 0.78 | POLB (0.50) | ALDH1A1POLBKDM4ETDP1PYGL | |
| SCHEMBL9847751 | 0.78 | TP53 (0.47) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL16790503 | 0.76 | CYP2D6 (0.53) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL16790521 | 0.75 | TP53 (0.56) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL19414023 | 0.74 | TP53 (0.54) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL8990309 | 0.74 | TP53 (0.44) | TP53CYP2D6CYP2C9ALOX15CYP2C19 | |
| SCHEMBL9847765 | 0.73 | ALDH1A1 (0.46) | CYP2C9ALDH1A1POLBKDM4ETDP1 |
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-0413415-A1 | Carboxylic acids and derivates thereof | The British Petroleum Company p.l.c. (GB) | 1991-02-20 | — | — | EP | disclosed |