Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.52 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.52 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.44 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.43 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.43 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 4/20 | 0.42 |
| ▸ | RAB9A | P51151 | 4/20 | 0.42 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.42 |
| ▸ | RECQL | P46063 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 2/20 | 0.41 |
| ▸ | CA2 | P00918 | 2/20 | 0.41 |
| ▸ | CA7 | P43166 | 2/20 | 0.41 |
| ▸ | CA13 | Q8N1Q1 | 2/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | GAA | P10253 | 1/20 | 0.41 |
| ▸ | USP2 | O75604 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL9647380 | 0.84 | ALDH1A1 (0.56) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL3444834 | 0.81 | ALDH1A1 (0.51) | ALDH1A1MAPK1CYP1A2CYP3A4CYP2C19 | |
| SCHEMBL5236263 | 0.81 | ALDH1A1 (0.52) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL8416274 | 0.77 | ALDH1A1 (0.47) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL6140666 | 0.74 | ALDH1A1 (0.54) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL11842736 | 0.73 | ALDH1A1 (0.56) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL3373578 | 0.72 | CA1 (0.66) | ALDH1A1MAPK1FFAR1CYP3A4NPC1 | |
| SCHEMBL9427645 | 0.72 | ALDH1A1 (0.56) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| SCHEMBL16586149 | 0.72 | ALDH1A1 (0.70) | ALDH1A1MAPK1FFAR1MTNR1AMTNR1B | |
| Sulfur Dioxide SCHEMBL27681092 | 0.72 | CA2 (0.59) | ALDH1A1MAPK1FFAR1CYP3A4NPC1 |
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-2861673-B1 | METAL FREE REACTIVE DYES, PROCESS FOR THE PRODUCTION THEREOF AND THEIR USE | DYSTAR COLOURS DISTRIB GMBH (DE) | 2023-08-09 | — | — | EP | disclosed |