Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.34 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | THRB | P10828 | 1/20 | 0.33 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL8018146 | 1.00 | ALDH1A1 (0.34) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL2701172 | 0.66 | TSHR (0.42) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL2698200 | 0.66 | TSHR (0.42) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL4367088 | 0.64 | TSHR (0.47) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL6750459 | 0.64 | TSHR (0.47) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL6524652 | 0.64 | TSHR (0.47) | ALDH1A1TSHRTHRBEPHX1 | |
| SCHEMBL2335043 | 0.61 | TSHR (0.41) | ALDH1A1TSHRTHRBEPHX1 | |
| Heptane SCHEMBL7024886 | 0.58 | — | — | |
| Hexadecane SCHEMBL23499901 | 0.58 | TSHR (1.00) | ALDH1A1TSHRTHRB | |
| Tetradecane SCHEMBL23924271 | 0.58 | TSHR (1.00) | ALDH1A1TSHRTHRB |
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-0970964-A2 | Method for producing titanium complex | SUMITOMO CHEMICAL COMPANY, LIMITED (JP) | 2000-01-12 | — | — | EP | disclosed |