Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | LMNA | P02545 | 3/20 | 0.45 |
| ▸ | TSHR | P16473 | 2/20 | 0.41 |
| ▸ | ACHE | P22303 | 1/20 | 0.41 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.39 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.39 |
| ▸ | CACNA1F | O60840 | 1/20 | 0.37 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.37 |
| ▸ | CACNA1D | Q01668 | 1/20 | 0.37 |
| ▸ | CACNA1S | Q13698 | 1/20 | 0.37 |
| ▸ | CACNA1C | Q13936 | 1/20 | 0.37 |
| ▸ | NFE2L2 | Q16236 | 1/20 | 0.37 |
| ▸ | GAA | P10253 | 3/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | HSP90AA1 | P07900 | 1/20 | 0.37 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.37 |
| ▸ | POLB | P06746 | 1/20 | 0.36 |
| ▸ | PDE4B | Q07343 | 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 | |
|---|---|---|---|---|
| SCHEMBL7490712 | 0.80 | LMNA (0.45) | LMNATSHRACHEALDH1A1CACNA1F | |
| SCHEMBL9668516 | 0.79 | LMNA (0.44) | LMNATSHRACHEALDH1A1SLC9A1 | |
| SCHEMBL10514938 | 0.76 | CACNA1C (0.45) | LMNATSHRCACNA1FADORA3CACNA1D | |
| SCHEMBL7433408 | 0.72 | MEN1 (0.44) | LMNATSHRACHEALDH1A1SLC9A1 | |
| SCHEMBL7416605 | 0.71 | LMNA (0.46) | LMNATSHRACHEALDH1A1CACNA1F | |
| SCHEMBL2781022 | 0.70 | CACNA1C (0.48) | LMNATSHRCACNA1FADORA3CACNA1D | |
| SCHEMBL7888022 | 0.70 | TSHR (0.50) | LMNATSHRACHEALDH1A1CACNA1F | |
| SCHEMBL30044577 | 0.70 | TSHR (0.50) | LMNATSHRACHEALDH1A1CACNA1F | |
| SCHEMBL3118873 | 0.69 | CYP1A2 (0.44) | LMNATSHRALDH1A1CACNA1FADORA3 | |
| Hydrochloric Acid SCHEMBL28628233 | 0.69 | TSHR (0.49) | LMNATSHRACHEALDH1A1CACNA1F |
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-0233228-A1 | PHARMACEUTICALLY ACTIVE 2-THIOMETHYL-SUBSTITUTED-1,4-DIHYDROPYRIDINES | BOEHRINGER MANNHEIM ITALIA S.P.A. (IT) | 1987-08-26 | — | — | EP | claimed |
| WO-1987000836-A1 | PHARMACEUTICALLY ACTIVE 2-THIOMETHYL-SUBSTITUTED-1,4-DIHYDROPYRIDINES | BOEHRINGER BIOCHEMIA ROBIN S.P.A. (IT) | 1987-02-12 | — | — | WO | claimed |