Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 8/20 | 0.50 |
| ▸ | TSHR | P16473 | 2/20 | 0.50 |
| ▸ | ERN1 | O75460 | 3/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.45 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.45 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.45 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.45 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.45 |
| ▸ | GRIA1 | P42261 | 1/20 | 0.44 |
| ▸ | GRIA2 | P42262 | 1/20 | 0.44 |
| ▸ | GRIA3 | P42263 | 1/20 | 0.44 |
| ▸ | GRIA4 | P48058 | 1/20 | 0.44 |
| ▸ | TDP1 | Q9NUW8 | 3/20 | 0.40 |
| ▸ | MEN1 | O00255 | 2/20 | 0.40 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.40 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.40 |
| ▸ | LMNA | P02545 | 2/20 | 0.40 |
| ▸ | THRB | P10828 | 1/20 | 0.40 |
| ▸ | BLM | P54132 | 1/20 | 0.40 |
| ▸ | MAPT | P10636 | 1/20 | 0.38 |
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 | |
|---|---|---|---|---|
| SCHEMBL446933 | 1.00 | ALDH1A1 (0.50) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL3687015 | 0.88 | GRIA1 (0.52) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL97117 | 0.88 | GRIA1 (0.52) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL2884919 | 0.87 | GRIA1 (0.56) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL19255286 | 0.87 | ALDH1A1 (0.41) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL686656 | 0.85 | CYP1A2 (0.55) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL23049567 | 0.81 | TDP1 (0.48) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL1397558 | 0.81 | ERN1 (0.50) | ALDH1A1TSHRERN1CYP1A2CYP3A4 | |
| SCHEMBL13556326 | 0.81 | ALDH1A1 (0.41) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 | |
| SCHEMBL3204262 | 0.81 | TSHR (0.48) | ALDH1A1TSHRERN1SMN1; SMN2CYP1A2 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-116940559-A | Cyclic diol compound, process for producing the compound, and use of the compound | 新日本理化株式会社 | 2023-10-24 | — | — | CN | disclosed |
| CN-116829618-A | Thermoplastic resin and optical lens comprising the same | 三菱瓦斯化学株式会社 | 2023-09-29 | — | — | CN | disclosed |