Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.44 |
| ▸ | CES1 | P23141 | 3/20 | 0.41 |
| ▸ | CES2 | O00748 | 2/20 | 0.35 |
| ▸ | TP53 | P04637 | 1/20 | 0.33 |
| ▸ | LMNA | P02545 | 3/20 | 0.32 |
| ▸ | CA1 | P00915 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.31 |
| ▸ | GAA | P10253 | 1/20 | 0.31 |
| ▸ | HTT | P42858 | 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 | |
|---|---|---|---|---|
| SCHEMBL3840440 | 0.89 | HTT (0.35) | ALDH1A1CES1CES2TP53LMNA | |
| SCHEMBL8048708 | 0.74 | ALDH1A1 (0.41) | ALDH1A1CES1CES2TP53HTT | |
| SCHEMBL6885842 | 0.70 | DGKA (0.43) | ALDH1A1CES1CES2LMNA | |
| SCHEMBL8823580 | 0.69 | ALDH1A1 (0.50) | ALDH1A1CES1CES2TP53LMNA | |
| SCHEMBL8809998 | 0.68 | ALDH1A1 (0.48) | ALDH1A1CES1CES2TP53LMNA | |
| SCHEMBL28174057 | 0.68 | CES2 (0.46) | ALDH1A1CES1CES2HSD17B10 | |
| SCHEMBL10951765 | 0.67 | ALDH1A1 (0.47) | ALDH1A1CES1CES2HSD17B10 | |
| SCHEMBL28145232 | 0.67 | ALDH1A1 (0.47) | ALDH1A1CES1CES2HSD17B10 | |
| SCHEMBL886851 | 0.66 | ALDH1A1 (0.44) | ALDH1A1CES1CES2LMNACA1 | |
| SCHEMBL6567217 | 0.66 | ALDH1A1 (0.45) | ALDH1A1CES1CES2HSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0465368-B1 | Sulfur derivatives of imidazole, process for their preparation, intermediates, their use as medicaments, and pharmaceutical compositions containing them | HOECHST MARION ROUSSEL INC (FR) | 1998-05-20 | — | — | EP | disclosed |
| EP-0465368-A1 | Sulfur derivatives of imidazole, process for their preparation, intermediates, their use as medicaments, and pharmaceutical compositions containing them | ROUSSEL UCLAF (FR) | 1992-01-08 | — | — | EP | disclosed |