Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | RAF1 | P04049 | 12/20 | 0.41 |
| ▸ | BRAF | P15056 | 9/20 | 0.39 |
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | RAB9A | P51151 | 2/20 | 0.38 |
| ▸ | MAPK13 | O15264 | 1/20 | 0.38 |
| ▸ | MAPK12 | P53778 | 1/20 | 0.38 |
| ▸ | MAPK11 | Q15759 | 1/20 | 0.38 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | TSHR | P16473 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| Isoxaben SCHEMBL6428745 | 1.00 | CYP1A2 (0.45) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| Isoxaben SCHEMBL8539623 | 0.86 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| Isoxaben SCHEMBL54432 | 0.86 | CYP1A2 (0.53) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| Isoxaben SCHEMBL9713018 | 0.85 | CYP1A2 (0.52) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| Isoxaben SCHEMBL10534875 | 0.84 | RAF1 (0.36) | RAF1BRAF | |
| Isoxaben SCHEMBL9715108 | 0.84 | RAF1 (0.36) | RAF1BRAF | |
| Isoxaben SCHEMBL9270606 | 0.82 | RAF1 (0.33) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| Isoxaben SCHEMBL8339490 | 0.81 | CYP1A2 (0.43) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| SCHEMBL16589802 | 0.80 | TAS1R3 (0.51) | CYP1A2CYP3A4CYP2C19RAF1BRAF | |
| SCHEMBL9713569 | 0.80 | CYP1A2 (0.46) | CYP1A2CYP3A4CYP2C19RAF1BRAF |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-1992010501-A1 | HERBICIDAL ETHERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-06-25 | — | — | WO | disclosed |
| WO-1992009587-A1 | HERBICIDAL OXAZINE ETHERS | E.I. DU PONT DE NEMOURS AND COMPANY (US) | 1992-06-11 | — | — | WO | disclosed |