Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.65 |
| ▸ | GLA | P06280 | 1/20 | 0.65 |
| ▸ | PKM | P14618 | 1/20 | 0.57 |
| ▸ | HTT | P42858 | 1/20 | 0.57 |
| ▸ | KMT2A | Q03164 | 6/20 | 0.54 |
| ▸ | MAPT | P10636 | 4/20 | 0.54 |
| ▸ | MEN1 | O00255 | 4/20 | 0.54 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.54 |
| ▸ | RAB9A | P51151 | 2/20 | 0.54 |
| ▸ | GAA | P10253 | 2/20 | 0.54 |
| ▸ | TRPV1 | Q8NER1 | 1/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.54 |
| ▸ | NPC1 | O15118 | 1/20 | 0.54 |
| ▸ | LMNA | P02545 | 2/20 | 0.53 |
| ▸ | MITF | O75030 | 1/20 | 0.53 |
| ▸ | PAX8 | Q06710 | 1/20 | 0.53 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.51 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL18985269 | 1.00 | ALDH1A1 (0.65) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL18985212 | 0.89 | ALDH1A1 (0.65) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL18985214 | 0.89 | ALDH1A1 (0.65) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL19003256 | 0.88 | ALDH1A1 (0.64) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL19003468 | 0.85 | ALDH1A1 (0.62) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL19003463 | 0.83 | ALDH1A1 (0.75) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL31162549 | 0.77 | ALDH1A1 (0.73) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL16592441 | 0.76 | PKM (0.78) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL16592442 | 0.76 | PKM (0.78) | ALDH1A1GLAPKMHTTKMT2A | |
| SCHEMBL20537804 | 0.74 | PTGS2 (0.68) | ALDH1A1GLAHTTKMT2AMAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | claimed |
| WO-2017102014-A1 | PROPENAMIDE THIOPHENE DERIVATIVES AS FLAVIVIRUS INHIBITORS AND THEIR USE | UNIVERSITE D'AIX-MARSEILLE (FR) | 2017-06-22 | — | — | WO | disclosed |