Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.33 |
| ▸ | ADH1B | P00325 | 1/20 | 0.31 |
| ▸ | ADH1C | P00326 | 1/20 | 0.31 |
| ▸ | ADH1A | P07327 | 1/20 | 0.31 |
| ▸ | ADH7 | P40394 | 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 | |
|---|---|---|---|---|
| SCHEMBL11761029 | 1.00 | ALDH1A1 (0.34) | ALDH1A1CYP2D6SMN1; SMN2LMNAADH1B | |
| SCHEMBL11763542 | 1.00 | ALDH1A1 (0.34) | ALDH1A1CYP2D6SMN1; SMN2LMNAADH1B | |
| SCHEMBL11761146 | 1.00 | ALDH1A1 (0.34) | ALDH1A1CYP2D6SMN1; SMN2LMNAADH1B | |
| SCHEMBL11762999 | 1.00 | ALDH1A1 (0.34) | ALDH1A1CYP2D6SMN1; SMN2LMNAADH1B | |
| Benzene SCHEMBL28031841 | 0.85 | ADH1B (0.41) | ALDH1A1CYP2D6SMN1; SMN2LMNAADH1B | |
| Hydrogen Peroxide SCHEMBL27648795 | 0.85 | — | — | |
| SCHEMBL25480 | 0.85 | — | — | |
| SCHEMBL28180337 | 0.83 | — | — | |
| Water SCHEMBL1273106 | 0.83 | — | — | |
| Ammonia Solution, Strong SCHEMBL27190158 | 0.83 | — | — |
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 |
|---|---|---|---|---|---|---|---|
| US-4021546-A | Pro-drug forms of digoxin and method of preparing and using same | INTERX RESEARCH CORPORATION (US) | 1977-05-03 | — | — | US | claimed |
| US-4021546-A | Pro-drug forms of digoxin and method of preparing and using same | INTERX RESEARCH CORPORATION (US) | 1977-05-03 | — | — | US | disclosed |