Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.52 |
| ▸ | TP53 | P04637 | 3/20 | 0.52 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.52 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.52 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.52 |
| ▸ | TSHR | P16473 | 1/20 | 0.52 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.52 |
| ▸ | PPARG | P37231 | 2/20 | 0.42 |
| ▸ | PPARD | Q03181 | 2/20 | 0.42 |
| ▸ | PPARA | Q07869 | 1/20 | 0.42 |
| ▸ | XDH | P47989 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 5/20 | 0.41 |
| ▸ | GABRB2 | P47870 | 5/20 | 0.41 |
| ▸ | CNR2 | P34972 | 4/20 | 0.41 |
| ▸ | MAPT | P10636 | 3/20 | 0.41 |
| ▸ | MEN1 | O00255 | 2/20 | 0.41 |
| ▸ | GAA | P10253 | 2/20 | 0.41 |
| ▸ | CNR1 | P21554 | 2/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL4556361 | 0.93 | ALDH1A1 (0.58) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL584333 | 0.88 | ALDH1A1 (0.56) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| Water SCHEMBL28100235 | 0.85 | ALDH1A1 (0.54) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL6513657 | 0.83 | ALDH1A1 (0.48) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| Allylbenzene SCHEMBL11226285 | 0.82 | TP53 (0.64) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL24125046 | 0.82 | KIF11 (0.39) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL19084220 | 0.81 | SMN1; SMN2 (0.62) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL3791364 | 0.80 | ALDH1A1 (0.45) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL173301 | 0.80 | ALDH1A1 (0.64) | ALDH1A1TP53CYP3A4SMN1; SMN2ALOX15 | |
| SCHEMBL2776957 | 0.80 | TP53 (0.56) | ALDH1A1TP53SMN1; SMN2TSHRMAPK1 |
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 |
|---|---|---|---|---|---|---|---|
| JP-5140004-A | — | — | None | — | — | JP | disclosed |
| JP-H05140004-A | PRODUCTION OF ETHYL-SUBSTITUTED BIPHENYL COMPOUNDS | NIPPON PETROCHEM CO LTD | 1993-06-08 | — | — | JP | disclosed |