Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.43 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.43 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.41 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.37 |
| ▸ | GAA | P10253 | 2/20 | 0.37 |
| ▸ | CA12 | O43570 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.37 |
| ▸ | CA2 | P00918 | 2/20 | 0.37 |
| ▸ | CA4 | P22748 | 2/20 | 0.37 |
| ▸ | CA6 | P23280 | 2/20 | 0.37 |
| ▸ | CA7 | P43166 | 2/20 | 0.37 |
| ▸ | CA9 | Q16790 | 2/20 | 0.37 |
| ▸ | CA14 | Q9ULX7 | 2/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | TSHR | P16473 | 4/20 | 0.37 |
| ▸ | TP53 | P04637 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL4692586 | 0.74 | CA2 (0.44) | ALDH1A1TDP1KDM4EGAACA12 | |
| SCHEMBL8186765 | 0.74 | ALDH1A1 (0.44) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL9309297 | 0.74 | ALDH1A1 (0.57) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL876479 | 0.69 | ALDH1A1 (0.51) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL3712689 | 0.69 | ALOX5 (0.44) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL30027075 | 0.69 | ALDH1A1 (0.51) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL69000 | 0.69 | ALDH1A1 (0.61) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL6752271 | 0.69 | ALDH1A1 (0.61) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| SCHEMBL69322 | 0.69 | ALDH1A1 (0.61) | ALDH1A1MAPK1ALOX5TDP1KDM4E | |
| Hydrochloric Acid SCHEMBL10700887 | 0.68 | ALOX5 (0.43) | ALDH1A1MAPK1ALOX5TDP1KDM4E |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-1417197-A1 | FUNGICIDAL 1-BENZOXEPIN DERIVATIVES | Bayer CropScience S.A. (FR) | 2004-05-12 | — | — | EP | disclosed |
| WO-2003014104-A1 | FUNGICIDAL 1-BENZOXEPIN DERIVATIVES | BAYER CROPSCIENCE SA (FR) | 2003-02-20 | — | — | WO | disclosed |