Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | RECQL | P46063 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.35 |
| ▸ | APP | P05067 | 4/20 | 0.33 |
| ▸ | CA12 | O43570 | 1/20 | 0.30 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA9 | Q16790 | 1/20 | 0.30 |
| ▸ | CYP19A1 | P11511 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL16957903 | 0.84 | — | — | |
| SCHEMBL16959969 | 0.81 | LTA4H (0.40) | GAACYP3A4CA12CA1CA9 | |
| SCHEMBL16955910 | 0.79 | ALDH1A1 (0.41) | ALDH1A1RECQLGAACYP3A4SMN1; SMN2 | |
| SCHEMBL16959218 | 0.79 | ALDH1A1 (0.41) | ALDH1A1RECQLGAACYP3A4SMN1; SMN2 | |
| SCHEMBL16956441 | 0.79 | ALDH1A1 (0.41) | ALDH1A1RECQLGAACYP3A4SMN1; SMN2 | |
| SCHEMBL16955846 | 0.79 | NQO1 (0.41) | ALDH1A1CYP3A4SMN1; SMN2CA12CA1 | |
| SCHEMBL16953564 | 0.75 | MAPT (0.44) | ALDH1A1GAASMN1; SMN2 | |
| SCHEMBL16955697 | 0.75 | MAPT (0.36) | ALDH1A1GAACYP3A4SMN1; SMN2 | |
| SCHEMBL16961798 | 0.74 | ALDH1A1 (0.57) | ALDH1A1RECQLGAANR1I2CA12 | |
| SCHEMBL16954026 | 0.72 | ALDH1A1 (0.37) | ALDH1A1RECQLGAACYP3A4SMN1; SMN2 |
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 |