Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | PRKCA | P17252 | 3/20 | 0.33 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.31 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL5790139 | 0.84 | ALDH1A1 (0.44) | ALDH1A1TSHRTHRBLMNAHSD17B10 | |
| SCHEMBL28332484 | 0.80 | ALDH1A1 (0.53) | ALDH1A1TSHRTHRBLMNAHSD17B10 | |
| Ethylene Glycol SCHEMBL1904641 | 0.79 | ALDH1A1 (0.40) | ALDH1A1TSHRTHRBLMNAHSD17B10 | |
| SCHEMBL11763394 | 0.78 | ALDH1A1 (0.41) | ALDH1A1TSHRPRKCA | |
| SCHEMBL15166572 | 0.78 | ALDH1A1 (0.60) | ALDH1A1TSHRTHRBLMNAHSD17B10 | |
| SCHEMBL5484671 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TSHRLMNAPRKCA | |
| SCHEMBL5480812 | 0.76 | ALDH1A1 (0.40) | ALDH1A1TSHRLMNAPRKCA | |
| SCHEMBL2611104 | 0.76 | ALDH1A1 (0.46) | ALDH1A1TSHRLMNAHSD17B10PRKCA | |
| SCHEMBL13672301 | 0.75 | ALDH1A1 (0.47) | ALDH1A1TSHRLMNAHSD17B10PRKCA | |
| SCHEMBL5484677 | 0.75 | ALDH1A1 (0.39) | ALDH1A1TSHRLMNAPRKCA |
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-1960477-B1 | NOVEL YELLOW PIGMENTS AND NON-AQUEOUS PIGMENT DISPERSIONS | AGFA GRAPHICS NV (BE) | 2011-05-04 | — | — | EP | disclosed |