Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PIK3CA | P42336 | 1/20 | 0.48 |
| ▸ | CYP11B1 | P15538 | 11/20 | 0.45 |
| ▸ | CYP11B2 | P19099 | 10/20 | 0.45 |
| ▸ | CYP19A1 | P11511 | 6/20 | 0.44 |
| ▸ | CYP17A1 | P05093 | 4/20 | 0.44 |
| ▸ | PGR | P06401 | 1/20 | 0.44 |
| ▸ | MEN1 | O00255 | 1/20 | 0.42 |
| ▸ | PSIP1 | O75475 | 1/20 | 0.42 |
| ▸ | AXL | P30530 | 1/20 | 0.42 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.42 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.41 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.41 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | HSD17B1 | P14061 | 1/20 | 0.40 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL16484808 | 1.00 | PIK3CA (0.48) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483691 | 0.97 | PIK3CA (0.48) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483693 | 0.97 | PIK3CA (0.51) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483679 | 0.96 | PIK3CA (0.52) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483222 | 0.96 | PIK3CA (0.48) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483224 | 0.96 | PIK3CA (0.48) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483064 | 0.95 | PIK3CA (0.54) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483373 | 0.95 | PIK3CA (0.54) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483668 | 0.94 | PIK3CA (0.50) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 | |
| SCHEMBL16483338 | 0.94 | PIK3CA (0.53) | PIK3CACYP11B1CYP11B2CYP19A1CYP17A1 |
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-2014057873-A1 | PHOSPHINE OXIDE DERIVATIVE AND LIGHT-EMITTING ELEMENT PROVIDED WITH SAME | 東レ株式会社 (JP) | 2014-04-17 | — | — | WO | disclosed |