Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AR | P10275 | 13/20 | 0.46 |
| ▸ | TAS2R14 | Q9NYV8 | 1/20 | 0.41 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.36 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.36 |
| ▸ | PTPN11 | Q06124 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | RECQL | P46063 | 1/20 | 0.36 |
| ▸ | CES2 | O00748 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.35 |
| ▸ | GAA | P10253 | 1/20 | 0.35 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL16962252 | 0.82 | AR (0.47) | ARTAS2R14PTPN1PTPN6PTPN11 | |
| SCHEMBL16958720 | 0.80 | CYP1A2 (0.35) | ARCYP1A2CYP2C9CYP2C19CES2 | |
| SCHEMBL16955672 | 0.78 | NOS3 (0.33) | ARALDH1A1 | |
| SCHEMBL16956416 | 0.78 | GABRA1 (0.38) | ARKDM4EALDH1A1GAA | |
| SCHEMBL16956711 | 0.77 | AR (0.44) | ARTAS2R14PTPN1PTPN6PTPN11 | |
| SCHEMBL16956715 | 0.76 | CES2 (0.39) | CYP2C19CES2KDM4EALDH1A1GAA | |
| SCHEMBL16958324 | 0.76 | MAOB (0.37) | CES2KDM4EALDH1A1GAA | |
| SCHEMBL16950454 | 0.76 | JAK2 (0.43) | CES2ALDH1A1GAA | |
| SCHEMBL16956845 | 0.76 | CES2 (0.39) | TAS2R14CYP2C19CES2KDM4EALDH1A1 | |
| SCHEMBL16960401 | 0.76 | GABRA1 (0.41) | CYP1A2CYP2C9CYP2C19KDM4EALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2900645-A1 | 3-PHENYLISOXAZOLIN DERIVATIVES WITH HERBICIDAL ACTION | Bayer CropScience AG (DE) | 2015-08-05 | — | — | EP | disclosed |