Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.47 |
| ▸ | MAPT | P10636 | 2/20 | 0.47 |
| ▸ | GAA | P10253 | 2/20 | 0.47 |
| ▸ | HPGD | P15428 | 3/20 | 0.43 |
| ▸ | MEN1 | O00255 | 5/20 | 0.41 |
| ▸ | KMT2A | Q03164 | 5/20 | 0.41 |
| ▸ | LMNA | P02545 | 1/20 | 0.40 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.40 |
| ▸ | TP53 | P04637 | 1/20 | 0.39 |
| ▸ | MAT2A | P31153 | 1/20 | 0.39 |
| ▸ | HIF1A | Q16665 | 1/20 | 0.39 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.39 |
| ▸ | TSHR | P16473 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL22760184 | 0.86 | MAPK8 (0.48) | ALDH1A1MAPTGAAHPGDMAT2A | |
| SCHEMBL22760086 | 0.85 | MAT2A (0.43) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22760115 | 0.84 | MAPT (0.46) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22760359 | 0.82 | ALDH1A1 (0.46) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22760172 | 0.82 | MAPT (0.47) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22747837 | 0.81 | ALDH1A1 (0.45) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22747885 | 0.79 | HPGD (0.45) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22760215 | 0.79 | HPGD (0.51) | ALDH1A1MAPTGAAHPGDMEN1 | |
| SCHEMBL22748257 | 0.78 | MAPT (0.48) | ALDH1A1MAPTGAAMEN1KMT2A | |
| SCHEMBL22760576 | 0.76 | MAT2A (0.41) | ALDH1A1MAPTGAAHPGDMEN1 |
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-2020244462-A1 | INDOLE DERIVATIVES AND PHARMACEUTICAL USE THEREOF | 中国药科大学 | 2020-12-10 | — | — | WO | disclosed |