Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.50 |
| ▸ | RAB9A | P51151 | 2/20 | 0.50 |
| ▸ | ULK1 | O75385 | 1/20 | 0.49 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.49 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.49 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.49 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.49 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.49 |
| ▸ | NPC1 | O15118 | 1/20 | 0.49 |
| ▸ | POLB | P06746 | 1/20 | 0.49 |
| ▸ | MAOB | P27338 | 1/20 | 0.49 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.48 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.48 |
| ▸ | PLA2G1B | P04054 | 1/20 | 0.46 |
| ▸ | ATG4B | Q9Y4P1 | 1/20 | 0.46 |
| ▸ | HAT1 | O14929 | 1/20 | 0.46 |
| ▸ | EP300 | Q09472 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL2485602 | 1.00 | ALDH1A1 (0.50) | ALDH1A1RAB9AULK1CYP2C19KMT2A | |
| Hydrochloric Acid SCHEMBL2484892 | 0.98 | ALDH1A1 (0.49) | ALDH1A1RAB9AULK1CYP2C19KMT2A | |
| SCHEMBL5224347 | 0.94 | CNR2 (0.51) | ALDH1A1RAB9ACYP2C19KMT2ACYP3A4 | |
| SCHEMBL4427598 | 0.94 | CNR2 (0.51) | ALDH1A1RAB9ACYP2C19KMT2ACYP3A4 | |
| SCHEMBL1696017 | 0.88 | MEN1 (0.59) | KMT2AMEN1CYP1A2 | |
| SCHEMBL19248981 | 0.88 | MEN1 (0.59) | KMT2AMEN1CYP1A2 | |
| SCHEMBL27827175 | 0.88 | MEN1 (0.59) | KMT2AMEN1CYP1A2 | |
| SCHEMBL6243334 | 0.85 | ALDH1A1 (0.55) | ALDH1A1KMT2AMEN1LMNA | |
| SCHEMBL2485050 | 0.84 | SMN1; SMN2 (0.59) | RAB9AKMT2AMEN1NPC1HAT1 | |
| SCHEMBL11350168 | 0.84 | CYP1A2 (0.56) | ALDH1A1CYP2C19KMT2ACYP2D6MEN1 |
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-2376489-B1 | ALKALOID AMINOESTER DERIVATIVES AND MEDICINAL COMPOSITION THEREOF | CHIESI FARMA SPA (IT) | 2015-04-22 | — | — | EP | disclosed |