Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.41 |
| ▸ | L3MBTL1 | Q9Y468 | 2/20 | 0.41 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.38 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | HTT | P42858 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.35 |
| ▸ | POLB | P06746 | 1/20 | 0.35 |
| ▸ | HPGD | P15428 | 1/20 | 0.35 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 2/20 | 0.34 |
| ▸ | RAB9A | P51151 | 2/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.34 |
| ▸ | GFER | P55789 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL30468629 | 0.86 | ALDH1A1 (0.39) | ALDH1A1L3MBTL1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL12844413 | 0.82 | GRM5 (0.46) | ALDH1A1L3MBTL1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL17520240 | 0.82 | ALDH1A1 (0.46) | ALDH1A1L3MBTL1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL12775799 | 0.79 | ALDH1A1 (0.44) | ALDH1A1L3MBTL1CYP1A2CYP3A4MEN1 | |
| SCHEMBL29048375 | 0.79 | L3MBTL1 (0.44) | ALDH1A1L3MBTL1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL13274135 | 0.78 | KDM4E (0.50) | ALDH1A1L3MBTL1CYP1A2CYP3A4MEN1 | |
| SCHEMBL1577612 | 0.73 | TSHR (0.47) | ALDH1A1L3MBTL1CYP1A2CYP3A4MEN1 | |
| SCHEMBL8617871 | 0.73 | HSD17B10 (0.51) | ALDH1A1L3MBTL1CYP1A2CYP3A4CYP2C9 | |
| SCHEMBL2601270 | 0.72 | NPC1 (0.52) | ALDH1A1L3MBTL1MEN1KMT2AKDM4E | |
| SCHEMBL2494002 | 0.72 | RAB9A (0.59) | ALDH1A1L3MBTL1CYP1A2KMT2ACYP2C19 |
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 |
|---|---|---|---|---|---|---|---|
| CN-114716459-B | Carboxyl substituted ruthenium complex, preparation method and application thereof | 广州大学 | 2023-07-07 | — | — | CN | claimed |