Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.35 |
| ▸ | LMNA | P02545 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL8843130 | 0.86 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15TSHR | |
| SCHEMBL9625073 | 0.86 | ALDH1A1 (0.44) | ALDH1A1LMNAHSD17B10ALOX15TSHR | |
| SCHEMBL9625714 | 0.81 | BTN3A1 (0.35) | — | |
| SCHEMBL9624397 | 0.81 | BTN3A1 (0.35) | — | |
| SCHEMBL9494567 | 0.81 | NPSR1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15TSHR | |
| SCHEMBL10454777 | 0.81 | NPSR1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15TSHR | |
| SCHEMBL9494561 | 0.81 | NPSR1 (0.41) | ALDH1A1LMNAHSD17B10ALOX15TSHR | |
| SCHEMBL22588817 | 0.79 | HCAR2 (0.38) | ALDH1A1LMNATSHR | |
| SCHEMBL28489021 | 0.79 | HCAR2 (0.38) | ALDH1A1LMNATSHR | |
| SCHEMBL9624085 | 0.78 | ALDH1A1 (0.32) | ALDH1A1TSHR |
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-0250997-B1 | VALPROIC AND (E)-2-VALPROENOIC ACID DERIVATIVES, PROCESSES FOR THE PREPARATION THEREOF AND PHARMACEUTICAL COMPOSITIONS THEREFROM | CHIESI FARMACEUTICI S.p.A. (IT) | 1992-04-15 | — | — | EP | claimed |