Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NPC1 | O15118 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | MAPT | P10636 | 1/20 | 0.32 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.31 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.30 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL5284832 | 0.86 | ALDH1A1 (0.34) | ALDH1A1MAPTSLC9A1POLBKDM4E | |
| SCHEMBL5274598 | 0.83 | SLC9A1 (0.37) | ALDH1A1MAPTSLC9A1KDM4ECYP1A2 | |
| SCHEMBL5277272 | 0.80 | SLC9A1 (0.40) | ALDH1A1MAPTSLC9A1 | |
| SCHEMBL5282394 | 0.79 | NPC1 (0.34) | NPC1ALDH1A1MAPTSLC9A1KDM4E | |
| SCHEMBL5289718 | 0.79 | GRM2 (0.35) | NPC1ALDH1A1SLC9A1 | |
| SCHEMBL5284830 | 0.79 | ALDH1A1 (0.36) | NPC1ALDH1A1MAPTSLC9A1POLB | |
| SCHEMBL5273637 | 0.78 | NPC1 (0.33) | NPC1ALDH1A1SLC9A1 | |
| SCHEMBL5276637 | 0.78 | NPC1 (0.33) | NPC1ALDH1A1SLC9A1 | |
| SCHEMBL5279157 | 0.77 | NPC1 (0.31) | NPC1 | |
| SCHEMBL5281565 | 0.75 | MAPT (0.35) | NPC1ALDH1A1MAPT |
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-1859781-A2 | Brightening and/or colouring agent with triazoles | Henkel Kommanditgesellschaft auf Aktien (DE) | 2007-11-28 | — | — | EP | disclosed |