Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | MAPT | P10636 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | TGFBR1 | P36897 | 9/20 | 0.43 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.42 |
| ▸ | ACP1 | P24666 | 1/20 | 0.42 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.41 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.41 |
| ▸ | AHR | P35869 | 2/20 | 0.41 |
| ▸ | NR1I3 | Q14994 | 2/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.41 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.41 |
| ▸ | ABCB1 | P08183 | 1/20 | 0.41 |
| ▸ | VDR | P11473 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.41 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.40 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL8818637 | 0.91 | GRM2 (0.47) | MAPTLMNATGFBR1MAPK14ACP1 | |
| SCHEMBL8815721 | 0.88 | KDM4E (0.53) | MAPTLMNATGFBR1MAPK14ACP1 | |
| SCHEMBL8817333 | 0.86 | CRHR1 (0.46) | MAPTLMNATGFBR1MAPK14ACP1 | |
| SCHEMBL8817481 | 0.86 | TGFBR1 (0.48) | TGFBR1MAPK14ADORA2A | |
| SCHEMBL8818706 | 0.86 | TGFBR1 (0.46) | MAPTLMNATGFBR1MAPK14NR1I3 | |
| SCHEMBL8818148 | 0.85 | MEN1 (0.50) | MAPTLMNATGFBR1MAPK14ACP1 | |
| SCHEMBL8816447 | 0.85 | TGFBR1 (0.45) | MAPTTGFBR1MAPK14NR1I3ABCG2 | |
| SCHEMBL8814815 | 0.84 | TGFBR1 (0.43) | MAPTTGFBR1MAPK14ACP1CYP1A2 | |
| SCHEMBL8818645 | 0.84 | TGFBR1 (0.44) | TGFBR1MAPK14ADORA2A | |
| SCHEMBL8818447 | 0.83 | ADORA2A (0.54) | MAPTTGFBR1MAPK14ADORA2A |
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 |