Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PKM | P14618 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LIG1 | P18858 | 1/20 | 0.32 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.31 |
| ▸ | TSHR | P16473 | 1/20 | 0.30 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL8791448 | 0.83 | PKM (0.38) | PKMSMN1; SMN2CYP3A4ALDH1A1LIG1 | |
| SCHEMBL19952924 | 0.83 | IDO1 (0.43) | PKMSMN1; SMN2CYP3A4ALDH1A1LIG1 | |
| SCHEMBL6796887 | 0.79 | CYP3A4 (0.44) | PKMSMN1; SMN2CYP3A4ALDH1A1LIG1 | |
| SCHEMBL3341018 | 0.78 | TSHR (0.52) | PKMSMN1; SMN2CYP3A4ALOX15TSHR | |
| SCHEMBL11276825 | 0.78 | TSHR (0.52) | PKMSMN1; SMN2CYP3A4ALOX15TSHR | |
| SCHEMBL8791835 | 0.75 | BACE1 (0.41) | PKMSMN1; SMN2 | |
| Benzene SCHEMBL28276614 | 0.74 | PKM (0.37) | PKMSMN1; SMN2CYP3A4ALDH1A1LIG1 | |
| SCHEMBL10706926 | 0.74 | ALDH1A1 (0.42) | PKMSMN1; SMN2CYP3A4ALDH1A1LIG1 | |
| SCHEMBL14066501 | 0.74 | PKM (0.35) | PKMSMN1; SMN2LIG1 | |
| SCHEMBL4683685 | 0.73 | SMN1; SMN2 (0.36) | PKMSMN1; SMN2CYP3A4ALDH1A1 |
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-0558959-A1 | Phosphonooxy and carbonate derivatives of taxol | Bristol-Myers Squibb Company (US) | 1993-09-08 | — | — | EP | disclosed |