Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL9713301 | 0.83 | ALDH1A1 (0.38) | ALDH1A1TDP1TSHRCYP3A4CA2 | |
| SCHEMBL82932 | 0.80 | — | — | |
| SCHEMBL15375165 | 0.79 | — | — | |
| SCHEMBL12540177 | 0.78 | ALDH1A1 (0.35) | ALDH1A1TDP1TSHRCYP3A4CA2 | |
| SCHEMBL17551536 | 0.77 | ALDH1A1 (0.52) | ALDH1A1TDP1 | |
| SCHEMBL1040900 | 0.76 | — | — | |
| Ammonia Solution, Strong SCHEMBL29005715 | 0.76 | ALDH1A1 (0.41) | ALDH1A1TDP1TSHRCYP3A4CA2 | |
| SCHEMBL10029046 | 0.76 | — | — | |
| SCHEMBL14923255 | 0.76 | — | — | |
| SCHEMBL7602462 | 0.76 | TSHR (0.38) | ALDH1A1TDP1TSHRCYP3A4CA2 |
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-1534680-B1 | PRENYLATION INHIBITORS AND METHODS OF THEIR SYNTHESIS AND USE | PHARMACO INVESTMENTS INC (US) | 2012-02-22 | — | — | EP | disclosed |