Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | AKT1 | P31749 | 1/20 | 0.38 |
| ▸ | PIK3CA | P42336 | 1/20 | 0.38 |
| ▸ | HTR6 | P50406 | 2/20 | 0.37 |
| ▸ | MAPT | P10636 | 3/20 | 0.36 |
| ▸ | SLC22A6 | Q4U2R8 | 1/20 | 0.35 |
| ▸ | MET | P08581 | 1/20 | 0.35 |
| ▸ | MEN1 | O00255 | 3/20 | 0.35 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.35 |
| ▸ | RXFP1 | Q9HBX9 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.35 |
| ▸ | AHR | P35869 | 1/20 | 0.35 |
| ▸ | GPR84 | Q9NQS5 | 1/20 | 0.35 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.35 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.35 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | CYP2A6 | P11509 | 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 | |
|---|---|---|---|---|
| SCHEMBL27148809 | 0.75 | SLC22A6 (0.50) | ALDH1A1GAAHTR6MAPTSLC22A6 | |
| SCHEMBL32896 | 0.72 | CYP3A4 (0.48) | ALDH1A1GAAHTR6MAPTSLC22A6 | |
| SCHEMBL4448917 | 0.70 | TP53 (0.40) | ALDH1A1GAAHTR6MAPTSLC22A6 | |
| SCHEMBL2037678 | 0.70 | MET (0.59) | ALDH1A1GAAHTR6MAPTMET | |
| SCHEMBL4449411 | 0.69 | AKR1B1 (0.62) | — | |
| SCHEMBL28939777 | 0.67 | SLC22A6 (0.49) | ALDH1A1GAAMAPTSLC22A6MEN1 | |
| SCHEMBL3456730 | 0.67 | ALDH1A1 (0.40) | ALDH1A1GAAHTR6MAPTSLC22A6 | |
| SCHEMBL15415994 | 0.66 | PBRM1 (0.52) | ALDH1A1GAAMAPTSLC22A6MEN1 | |
| SCHEMBL5513343 | 0.66 | SLC22A6 (0.47) | ALDH1A1GAAMAPTSLC22A6MEN1 | |
| SCHEMBL517162 | 0.66 | SLC22A6 (0.47) | ALDH1A1GAAMAPTSLC22A6MEN1 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2255627-A2 | Fungicidal mixtures | BASF SE (DE) | 2010-12-01 | — | — | EP | disclosed |
| EP-2255630-A2 | Fungicidal mixtures | BASF SE (DE) | 2010-12-01 | — | — | EP | disclosed |
| EP-2255629-A2 | Fungicidal mixtures | BASF SE (DE) | 2010-12-01 | — | — | EP | disclosed |
| EP-2255628-A2 | Fungicidal mixtures | BASF SE (DE) | 2010-12-01 | — | — | EP | disclosed |