Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.33 |
| ▸ | SQOR | Q9Y6N5 | 1/20 | 0.31 |
| ▸ | MEN1 | O00255 | 1/20 | 0.30 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16092619 | 0.84 | CYP1A2 (0.48) | CYP1A2ALDH1A1HTTSQORMEN1 | |
| SCHEMBL26287857 | 0.78 | ALDH1A1 (0.41) | ALDH1A1MEN1KMT2A | |
| SCHEMBL16796101 | 0.77 | CYP1A2 (0.53) | CYP1A2ALDH1A1HTTSQORMEN1 | |
| SCHEMBL11847291 | 0.74 | CYP1A2 (0.41) | CYP1A2ALDH1A1HTTSQORMEN1 | |
| SCHEMBL4674449 | 0.74 | CYP1A2 (0.41) | CYP1A2ALDH1A1HTTMEN1KMT2A | |
| SCHEMBL26980552 | 0.74 | CCNA2 (0.41) | SQOR | |
| SCHEMBL3711242 | 0.72 | CYP1A2 (0.37) | CYP1A2ALDH1A1SQORMEN1KMT2A | |
| SCHEMBL8568142 | 0.72 | ALDH1A1 (0.35) | ALDH1A1 | |
| SCHEMBL14878303 | 0.71 | CYP1A2 (0.36) | CYP1A2 | |
| SCHEMBL9432184 | 0.71 | CYP1A2 (0.61) | CYP1A2ALDH1A1HTTMEN1KMT2A |
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-2012069601-A1 | SUBSTITUTED QUINAZOLINES AS FUNGICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-05-31 | — | — | WO | disclosed |