Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.33 |
| ▸ | LMNA | P02545 | 1/20 | 0.33 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.33 |
| ▸ | HCAR2 | Q8TDS4 | 1/20 | 0.31 |
| ▸ | GLO1 | Q04760 | 1/20 | 0.30 |
| ▸ | TRPA1 | O75762 | 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 | |
|---|---|---|---|---|
| SCHEMBL9901309 | 1.00 | ALDH1A1 (0.33) | ALDH1A1LMNAHSD17B10HCAR2GLO1 | |
| SCHEMBL221550 | 0.86 | — | — | |
| SCHEMBL221551 | 0.86 | — | — | |
| Ammonia Solution, Strong SCHEMBL10537654 | 0.84 | ALDH1A1 (0.35) | ALDH1A1LMNAHSD17B10HCAR2GLO1 | |
| SCHEMBL23123465 | 0.78 | GLO1 (0.41) | ALDH1A1LMNAHSD17B10GLO1 | |
| SCHEMBL28741654 | 0.78 | ALDH1A1 (0.31) | ALDH1A1LMNAHSD17B10 | |
| Methacrylic Acid SCHEMBL29282688 | 0.78 | THRB (0.34) | ALDH1A1LMNAHSD17B10 | |
| SCHEMBL31278293 | 0.78 | GLO1 (0.45) | ALDH1A1LMNAHSD17B10HCAR2GLO1 | |
| SCHEMBL23123466 | 0.78 | GLO1 (0.41) | ALDH1A1LMNAHSD17B10GLO1 | |
| Methacrylic Acid SCHEMBL5914441 | 0.78 | THRB (0.34) | ALDH1A1LMNAHSD17B10 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2012078802-A1 | PREPARATION OF SUBSTITUTED-4,5-DIHYDROPYRROLO[4,3,2-de][2,6]NAPHTHYRIDIN-3(1H)-ONES | TAKEDA PHARMACEUTICAL COMPANY LIMITED (JP) | 2012-06-14 | — | — | WO | disclosed |