Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.37 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.34 |
| ▸ | ADORA2B | P29275 | 1/20 | 0.34 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.33 |
| ▸ | MEN1 | O00255 | 1/20 | 0.33 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.33 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.33 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.33 |
| ▸ | TOP2A | P11388 | 1/20 | 0.32 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.30 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
| ▸ | POLB | P06746 | 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 | |
|---|---|---|---|---|
| SCHEMBL5279740 | 0.89 | SLC9A1 (0.40) | SLC9A1ALDH1A1GRM2MEN1KMT2A | |
| SCHEMBL5280311 | 0.86 | SLC9A1 (0.43) | SLC9A1ALDH1A1GRM2TOP2AHCAR3 | |
| SCHEMBL5278674 | 0.85 | SLC9A1 (0.35) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5276554 | 0.84 | MAOA (0.38) | SLC9A1ALDH1A1ADORA2AADORA2BGRM2 | |
| SCHEMBL5273410 | 0.82 | SLC9A1 (0.38) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5282960 | 0.82 | SLC9A1 (0.38) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5274680 | 0.81 | GRM2 (0.40) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5281881 | 0.81 | SLC9A1 (0.37) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5284542 | 0.81 | SLC9A1 (0.37) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B | |
| SCHEMBL5279690 | 0.79 | SLC9A1 (0.36) | SLC9A1ALDH1A1CYP1A2ADORA2AADORA2B |
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 |