Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | MEN1 | O00255 | 1/20 | 0.43 |
| ▸ | LMNA | P02545 | 1/20 | 0.43 |
| ▸ | MAPT | P10636 | 1/20 | 0.43 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.43 |
| ▸ | RECQL | P46063 | 1/20 | 0.43 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.40 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.40 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL9329486 | 1.00 | ALDH1A1 (0.43) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL9646097 | 0.89 | ALDH1A1 (0.41) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL9730293 | 0.89 | ALDH1A1 (0.41) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL9729795 | 0.89 | ALDH1A1 (0.41) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL22074662 | 0.87 | POLB (0.41) | ALDH1A1LMNAMAPTKMT2A | |
| SCHEMBL2107443 | 0.87 | TUBB4A (0.33) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL2107437 | 0.87 | TUBB4A (0.33) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL9329187 | 0.79 | LMNA (0.42) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL9329194 | 0.79 | LMNA (0.42) | ALDH1A1MEN1LMNAMAPTALOX12 | |
| SCHEMBL11256734 | 0.77 | ALDH1A1 (0.49) | ALDH1A1MEN1LMNAMAPTALOX12 |
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-5336682-A | Heterocyclic compounds as fungicides | IMPERIAL CHEMICAL INDUSTRIES PUBLIC LIMITED COMPANY (GB) | 1994-08-09 | — | — | US | disclosed |
| EP-0331966-A1 | Substituted acrylic-acid esters | BAYER AG (DE) | 1989-09-13 | — | — | EP | disclosed |