Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GRM2 | Q14416 | 2/20 | 0.40 |
| ▸ | SLC9A1 | P19634 | 1/20 | 0.37 |
| ▸ | TOP2A | P11388 | 1/20 | 0.35 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.33 |
| ▸ | CTSK | P43235 | 4/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | CYP17A1 | P05093 | 1/20 | 0.30 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.30 |
| ▸ | HCAR3 | P49019 | 1/20 | 0.30 |
| ▸ | CYP1A2 | P05177 | 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 | |
|---|---|---|---|---|
| SCHEMBL5279410 | 0.89 | GRM2 (0.43) | GRM2SLC9A1TOP2AALDH1A1HPGD | |
| SCHEMBL5273306 | 0.86 | SLC9A1 (0.43) | GRM2SLC9A1TOP2AALDH1A1HCAR3 | |
| SCHEMBL5279312 | 0.84 | GRM2 (0.37) | GRM2SLC9A1TOP2AALDH1A1HPGD | |
| SCHEMBL5277800 | 0.81 | SLC9A1 (0.37) | GRM2SLC9A1TOP2AALDH1A1CTSK | |
| SCHEMBL5279348 | 0.81 | SLC9A1 (0.37) | GRM2SLC9A1TOP2AALDH1A1CTSK | |
| SCHEMBL5281408 | 0.81 | SLC9A1 (0.37) | GRM2SLC9A1TOP2AALDH1A1CTSK | |
| SCHEMBL5282659 | 0.79 | GRM2 (0.44) | GRM2SLC9A1TOP2AALDH1A1GRIA4 | |
| SCHEMBL5288377 | 0.79 | SLC9A1 (0.36) | GRM2SLC9A1TOP2AALDH1A1CTSK | |
| SCHEMBL5280172 | 0.79 | GRIA4 (0.39) | GRM2SLC9A1TOP2AALDH1A1CTSK | |
| SCHEMBL5280262 | 0.79 | GRM2 (0.39) | GRM2SLC9A1TOP2AALDH1A1CYP17A1 |
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 |