Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.53 |
| ▸ | GAA | P10253 | 2/20 | 0.53 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.53 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.53 |
| ▸ | MEN1 | O00255 | 4/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 4/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 3/20 | 0.47 |
| ▸ | HTT | P42858 | 2/20 | 0.47 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.47 |
| ▸ | MAPT | P10636 | 4/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | THRB | P10828 | 1/20 | 0.41 |
| ▸ | HRH3 | Q9Y5N1 | 5/20 | 0.38 |
| ▸ | HPGD | P15428 | 2/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | TP53 | P04637 | 2/20 | 0.37 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL25919303 | 1.00 | ALDH1A1 (0.53) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL25417521 | 0.81 | ALDH1A1 (0.53) | ALDH1A1GAAMAPK1HSD17B10SMN1; SMN2 | |
| SCHEMBL25417330 | 0.81 | ALDH1A1 (0.53) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL357762 | 0.79 | MEN1 (0.44) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL23975594 | 0.74 | ALDH1A1 (0.59) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL14479660 | 0.74 | ALDH1A1 (0.59) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL21737951 | 0.71 | ALDH1A1 (0.61) | ALDH1A1GAAMAPK1HSD17B10SMN1; SMN2 | |
| SCHEMBL25900585 | 0.70 | OGA (0.53) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL5631018 | 0.69 | ALDH1A1 (1.00) | ALDH1A1GAAMAPK1HSD17B10MEN1 | |
| SCHEMBL11372459 | 0.69 | ALDH1A1 (1.00) | ALDH1A1GAAMAPK1HSD17B10MEN1 |
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-3356361-B1 | HYDROXYALKYL THIADIAZOLE DERIVATIVES | DAIICHI SANKYO CO LTD (JP) | 2020-07-08 | — | — | EP | disclosed |