Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.54 |
| ▸ | F2 | P00734 | 1/20 | 0.54 |
| ▸ | GLA | P06280 | 1/20 | 0.54 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.46 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.46 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.44 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.44 |
| ▸ | BACE1 | P56817 | 2/20 | 0.43 |
| ▸ | LMNA | P02545 | 3/20 | 0.41 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.41 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.41 |
| ▸ | MEN1 | O00255 | 1/20 | 0.41 |
| ▸ | TTR | P02766 | 1/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.41 |
| ▸ | TNFSF11 | O14788 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL28938407 | 0.82 | MKNK2 (0.53) | MKNK1MKNK2CYP1A1CYP1B1CYP3A4 | |
| SCHEMBL26698249 | 0.81 | MKNK2 (0.44) | ALDH1A1F2GLAHPGDMKNK1 | |
| SCHEMBL919577 | 0.81 | ALDH1A1 (0.55) | ALDH1A1F2GLAHPGDBACE1 | |
| SCHEMBL12736324 | 0.80 | LMNA (0.53) | ALDH1A1F2GLAHPGDLMNA | |
| SCHEMBL26698318 | 0.80 | CYP3A4 (0.53) | ALDH1A1F2GLAHPGDLMNA | |
| SCHEMBL744752 | 0.80 | CYP1A1 (0.61) | ALDH1A1MKNK1MKNK2CYP1A1CYP1B1 | |
| SCHEMBL21409135 | 0.79 | RAF1 (0.43) | ALDH1A1MKNK1MKNK2CYP1A1CYP1B1 | |
| SCHEMBL22031512 | 0.79 | KMT2A (0.43) | MKNK1MKNK2CYP1A1CYP1B1MAPT | |
| SCHEMBL5015505 | 0.78 | POLB (0.46) | — | |
| SCHEMBL27353302 | 0.78 | CYP11B1 (0.45) | ALDH1A1F2GLAHPGDMKNK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2023226965-A1 | ROCK INHIBITORS AND USES THEREOF | DIZAL (JIANGSU) PHARMACEUTICAL CO., LTD. (CN) | 2023-11-30 | — | — | WO | disclosed |