Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIRT6 | Q8N6T7 | 1/20 | 0.50 |
| ▸ | AR | P10275 | 10/20 | 0.46 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.46 |
| ▸ | LMNA | P02545 | 2/20 | 0.46 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.46 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.46 |
| ▸ | TSHR | P16473 | 2/20 | 0.46 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.46 |
| ▸ | PGR | P06401 | 2/20 | 0.46 |
| ▸ | CES2 | O00748 | 1/20 | 0.46 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.46 |
| ▸ | GLA | P06280 | 1/20 | 0.46 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.46 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.46 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.46 |
| ▸ | TBXA2R | P21731 | 1/20 | 0.46 |
| ▸ | AADAC | P22760 | 1/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL4100002 | 0.85 | ALDH5A1 (0.53) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL16957012 | 0.83 | AR (0.49) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL29190121 | 0.78 | XDH (0.45) | ARCYP3A4LMNACYP1A2CYP2C9 | |
| SCHEMBL1546955 | 0.77 | TDP1 (0.58) | CYP3A4LMNACYP1A2CYP2C9TSHR | |
| SCHEMBL2096459 | 0.77 | SIRT6 (0.50) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL7081575 | 0.76 | SIRT6 (0.44) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL16950538 | 0.76 | APP (0.40) | ARCYP3A4LMNASMN1; SMN2PGR | |
| SCHEMBL16952720 | 0.76 | AR (0.46) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL2639009 | 0.75 | SIRT6 (0.51) | SIRT6ARCYP3A4LMNACYP1A2 | |
| SCHEMBL1998640 | 0.75 | CYP3A4 (0.52) | SIRT6ARCYP3A4LMNACYP1A2 |
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 |