Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.51 |
| ▸ | KLK3 | P07288 | 1/20 | 0.46 |
| ▸ | MEN1 | O00255 | 3/20 | 0.45 |
| ▸ | MAPT | P10636 | 3/20 | 0.45 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.45 |
| ▸ | GUSB | P08236 | 1/20 | 0.45 |
| ▸ | F2 | P00734 | 1/20 | 0.45 |
| ▸ | C1R | P00736 | 1/20 | 0.45 |
| ▸ | TGFBR1 | P36897 | 9/20 | 0.45 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.45 |
| ▸ | ABCG2 | Q9UNQ0 | 1/20 | 0.40 |
| ▸ | CFTR | P13569 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | RAB9A | P51151 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL8816304 | 0.81 | KMT2A (0.53) | ALDH1A1MEN1MAPTKMT2AGUSB | |
| SCHEMBL18624563 | 0.81 | ABCG2 (0.59) | ALDH1A1MEN1MAPTKMT2AGUSB | |
| SCHEMBL8818444 | 0.81 | ADORA2A (0.56) | ALDH1A1MEN1MAPTKMT2ATGFBR1 | |
| SCHEMBL8815685 | 0.81 | TGFBR1 (0.51) | ALDH1A1TGFBR1MAPK14 | |
| SCHEMBL8817142 | 0.79 | TGFBR1 (0.47) | ALDH1A1TGFBR1MAPK14 | |
| SCHEMBL8815690 | 0.79 | TGFBR1 (0.49) | ALDH1A1TGFBR1MAPK14MAPK1 | |
| SCHEMBL8818439 | 0.79 | TGFBR1 (0.49) | MAPTKMT2ATGFBR1MAPK14MAPK1 | |
| SCHEMBL8818447 | 0.79 | ADORA2A (0.54) | MEN1MAPTKMT2ATGFBR1MAPK14 | |
| SCHEMBL8816938 | 0.78 | TGFBR1 (0.50) | TGFBR1MAPK14 | |
| SCHEMBL8814758 | 0.77 | TGFBR1 (0.47) | MEN1KMT2ATGFBR1MAPK14RAB9A |
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-2012066122-A1 | 2 - (PYRIDIN- 2 -YL) -QUINAZOLINE DERIVATIVES AND THEIR USE AS MICROBICIDES | SYNGENTA PARTICIPATIONS AG (CH) | 2012-05-24 | — | — | WO | disclosed |