Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ERN1 | O75460 | 1/20 | 0.39 |
| ▸ | APLNR | P35414 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.38 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.38 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.38 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.38 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.37 |
| ▸ | ESR1 | P03372 | 1/20 | 0.36 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.36 |
| ▸ | ESR2 | Q92731 | 1/20 | 0.36 |
| ▸ | HMGCR | P04035 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL16959550 | 0.86 | ERN1 (0.44) | ERN1APLNRALDH1A1CYP1A1CYP1A2 | |
| SCHEMBL16956577 | 0.85 | NQO1 (0.42) | ALDH1A1CYP1A2TP53CYP3A4TSHR | |
| SCHEMBL16952195 | 0.83 | ERN1 (0.42) | ERN1APLNRALDH1A1CYP1A1CYP1A2 | |
| SCHEMBL16950970 | 0.81 | GPR3 (0.37) | CYP1A2TP53CYP3A4ALOX15TSHR | |
| SCHEMBL630627 | 0.81 | ERN1 (0.43) | ERN1APLNRALDH1A1CYP1A1CYP1A2 | |
| SCHEMBL629324 | 0.81 | ERN1 (0.40) | ERN1APLNRALDH1A1CYP1A1CYP1A2 | |
| SCHEMBL29216334 | 0.79 | POLB (0.48) | ERN1ALDH1A1TP53SMN1; SMN2POLB | |
| SCHEMBL13802275 | 0.77 | ADRA1A (0.48) | APLNRADRA1ATAAR1POLBHMGCR | |
| SCHEMBL13643151 | 0.77 | ALOX5 (0.46) | CYP1A2 | |
| SCHEMBL12802540 | 0.77 | CNR1 (0.41) | THRB |
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 |