Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | ADORA3 | P0DMS8 | 6/20 | 0.38 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.38 |
| ▸ | ADORA2B | P29275 | 2/20 | 0.38 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.36 |
| ▸ | ALPL | P05186 | 1/20 | 0.36 |
| ▸ | TAS1R3 | Q7RTX0 | 1/20 | 0.36 |
| ▸ | TAS1R1 | Q7RTX1 | 1/20 | 0.36 |
| ▸ | TAS1R2 | Q8TE23 | 1/20 | 0.36 |
| ▸ | PDCD1LG2 | Q9BQ51 | 4/20 | 0.35 |
| ▸ | CD274 | Q9NZQ7 | 4/20 | 0.35 |
| ▸ | SCN9A | Q15858 | 1/20 | 0.35 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.35 |
| ▸ | SCN3A | Q9NY46 | 1/20 | 0.35 |
| ▸ | SCN10A | Q9Y5Y9 | 1/20 | 0.35 |
| ▸ | CNR1 | P21554 | 1/20 | 0.35 |
| ▸ | CNR2 | P34972 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL2465978 | 0.92 | ALDH1A1 (0.38) | ALDH1A1ADORA3ADORA2AADORA2BNUDT1 | |
| SCHEMBL2464613 | 0.89 | ADORA2A (0.39) | ALDH1A1ADORA3ADORA2AADORA2BNUDT1 | |
| SCHEMBL2464008 | 0.88 | NUDT1 (0.41) | ALDH1A1ADORA3NUDT1ALPLPDCD1LG2 | |
| SCHEMBL17797246 | 0.86 | ALDH1A1 (0.36) | ALDH1A1ADORA3NUDT1ALPLPDCD1LG2 | |
| SCHEMBL2468173 | 0.85 | ADORA2A (0.39) | ALDH1A1ADORA3ADORA2AADORA2BPDCD1LG2 | |
| SCHEMBL2470012 | 0.85 | ALDH1A1 (0.38) | ALDH1A1ADORA3NUDT1ALPLPDCD1LG2 | |
| SCHEMBL17797223 | 0.85 | RORC (0.40) | ALDH1A1ADORA3TAS1R3TAS1R1 | |
| SCHEMBL2468120 | 0.85 | ALDH1A1 (0.36) | ALDH1A1ADORA3ADORA2ANUDT1SCN9A | |
| SCHEMBL2470407 | 0.85 | PDCD1LG2 (0.38) | ALDH1A1ALPLPDCD1LG2CD274SCN9A | |
| SCHEMBL17797205 | 0.84 | ALDH1A1 (0.38) | ALDH1A1ADORA3NUDT1ALPLPDCD1LG2 |
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 6 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2060566-B1 | Poly-substituted aryls | DOW AGROSCIENCES LLC (US) | 2016-06-08 | — | — | EP | claimed |
| EP-2939540-A1 | HERBICIDE SAFENER COMBINATION | Bayer Intellectual Property GmbH (DE) | 2015-11-04 | — | — | EP | disclosed |
| EP-2939541-A1 | HERBICIDE SAFENER COMBINATION | Bayer Intellectual Property GmbH (DE) | 2015-11-04 | — | — | EP | disclosed |
| EP-2369929-A2 | HERBICIDE-SAFENER COMBINATION | Bayer CropScience AG (DE) | 2011-10-05 | — | — | EP | disclosed |
| WO-2010060581-A2 | HERBICIDE-SAFENER COMBINATION | BAYER CROPSCIENCE AG (DE) | 2010-06-03 | — | — | WO | disclosed |
| EP-2191719-A1 | Herbicide safener combination | Bayer CropScience AG (DE) | 2010-06-02 | — | — | EP | disclosed |