Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EPHX2 | P34913 | 3/20 | 0.77 |
| ▸ | ALDH1A1 | P00352 | 10/20 | 0.71 |
| ▸ | CYP3A4 | P08684 | 9/20 | 0.71 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.71 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.71 |
| ▸ | TSHR | P16473 | 4/20 | 0.70 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.66 |
| ▸ | USP2 | O75604 | 4/20 | 0.64 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.64 |
| ▸ | HIF1A | Q16665 | 2/20 | 0.62 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.58 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.58 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL15171045 | 0.87 | EPHX2 (1.00) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934517 | 0.87 | EPHX2 (1.00) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934574 | 0.82 | EPHX2 (0.78) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934353 | 0.81 | EPHX2 (0.57) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934390 | 0.81 | EPHX2 (1.00) | EPHX2CYP3A4CYP1A2TSHRUSP2 | |
| SCHEMBL14934396 | 0.81 | EPHX2 (0.64) | EPHX2CYP3A4CYP1A2CYP2C9TSHR | |
| SCHEMBL14934398 | 0.80 | EPHX2 (0.79) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934401 | 0.80 | EPHX2 (0.69) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 | |
| SCHEMBL14934583 | 0.80 | EPHX2 (0.79) | EPHX2CYP3A4CYP1A2CYP2C9TSHR | |
| SCHEMBL14934368 | 0.79 | EPHX2 (0.68) | EPHX2ALDH1A1CYP3A4CYP1A2CYP2C9 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2013065712-A1 | DIAZASPIROUREA DERIVATIVE AND PHARMACEUTICAL USE THEREOF | 東レ株式会社 (JP) | 2013-05-10 | — | — | WO | disclosed |