Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.46 |
| ▸ | HTT | P42858 | 2/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | POLB | P06746 | 3/20 | 0.37 |
| ▸ | NOS3 | P29474 | 2/20 | 0.37 |
| ▸ | NOS2 | P35228 | 2/20 | 0.37 |
| ▸ | NOS1 | P29475 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.34 |
| ▸ | TSHR | P16473 | 2/20 | 0.34 |
| ▸ | TP53 | P04637 | 1/20 | 0.34 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.32 |
| ▸ | PGK1 | P00558 | 2/20 | 0.31 |
| ▸ | PGK2 | P07205 | 2/20 | 0.31 |
| ▸ | MAP4K1 | Q92918 | 1/20 | 0.31 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 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 | |
|---|---|---|---|---|
| SCHEMBL9722554 | 0.92 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL5141175 | 0.90 | ALDH1A1 (0.45) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL9712137 | 0.88 | ALDH1A1 (0.44) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL42756 | 0.85 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL29430615 | 0.85 | ALDH1A1 (0.46) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL117142 | 0.85 | HTT (0.46) | ALDH1A1HTTMAPTPOLBNOS3 | |
| Ammonia Solution, Strong SCHEMBL4989525 | 0.83 | ALDH1A1 (0.44) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL31329205 | 0.83 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL1333373 | 0.83 | ALDH1A1 (0.52) | ALDH1A1HTTMAPTPOLBNOS3 | |
| SCHEMBL24156023 | 0.83 | HTT (0.40) | ALDH1A1HTTMAPTPOLBNOS3 |
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-0376674-B1 | Spray urethane elastomer | MITSUI TOATSU CHEMICALS (JP) | 1995-03-22 | — | — | EP | disclosed |