Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 1/20 | 0.37 |
| ▸ | DHODH | Q02127 | 6/20 | 0.36 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.34 |
| ▸ | SORT1 | Q99523 | 3/20 | 0.34 |
| ▸ | GABRP | O00591 | 1/20 | 0.33 |
| ▸ | GABRD | O14764 | 1/20 | 0.33 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.33 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.33 |
| ▸ | GABRG2 | P18507 | 1/20 | 0.33 |
| ▸ | GABRB3 | P28472 | 1/20 | 0.33 |
| ▸ | GABRA5 | P31644 | 1/20 | 0.33 |
| ▸ | GABRA3 | P34903 | 1/20 | 0.33 |
| ▸ | GABRA2 | P47869 | 1/20 | 0.33 |
| ▸ | GABRB2 | P47870 | 1/20 | 0.33 |
| ▸ | GABRA4 | P48169 | 1/20 | 0.33 |
| ▸ | GABRE | P78334 | 1/20 | 0.33 |
| ▸ | GABRA6 | Q16445 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL14222530 | 0.90 | NPC1 (0.40) | NPC1ALDH1A1LMNAGAADHODH | |
| SCHEMBL14219689 | 0.88 | DHODH (0.39) | NPC1ALDH1A1LMNAGAADHODH | |
| SCHEMBL14220106 | 0.88 | DHODH (0.46) | LMNAGAADHODHMAP2K1SORT1 | |
| SCHEMBL14219688 | 0.88 | LMNA (0.36) | LMNAGAADHODHMAP2K1GABRP | |
| SCHEMBL14219679 | 0.84 | MAP2K1 (0.46) | NPC1ALDH1A1LMNAGAADHODH | |
| SCHEMBL14219814 | 0.84 | DHODH (0.43) | LMNAGAADHODHMAP2K1SORT1 | |
| SCHEMBL14219822 | 0.81 | DHODH (0.38) | LMNAGAADHODHMAP2K1 | |
| SCHEMBL14219622 | 0.81 | MAP2K1 (0.47) | MAP2K1EGFR | |
| SCHEMBL14219723 | 0.80 | MAP2K1 (0.39) | NPC1ALDH1A1MAP2K1EGFRMEN1 | |
| SCHEMBL14219677 | 0.80 | DHODH (0.39) | DHODHMAP2K1 |
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-1908751-A1 | N-hydroxy benzamides with antitumour activity | EOS S.p.A. (IT) | 2008-04-09 | — | — | EP | disclosed |