Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 3/20 | 0.40 |
| ▸ | CA1 | P00915 | 2/20 | 0.40 |
| ▸ | CA12 | O43570 | 2/20 | 0.40 |
| ▸ | CA9 | Q16790 | 2/20 | 0.40 |
| ▸ | CA3 | P07451 | 1/20 | 0.40 |
| ▸ | CA6 | P23280 | 1/20 | 0.40 |
| ▸ | CA5A | P35218 | 1/20 | 0.40 |
| ▸ | CA7 | P43166 | 1/20 | 0.40 |
| ▸ | CA5B | Q9Y2D0 | 1/20 | 0.40 |
| ▸ | RECQL | P46063 | 1/20 | 0.40 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | GAA | P10253 | 2/20 | 0.38 |
| ▸ | PPARG | P37231 | 1/20 | 0.37 |
| ▸ | GBA1 | P04062 | 1/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.37 |
| ▸ | MMP1 | P03956 | 1/20 | 0.37 |
| ▸ | MMP2 | P08253 | 1/20 | 0.37 |
| ▸ | MMP9 | P14780 | 1/20 | 0.37 |
| ▸ | MMP8 | P22894 | 1/20 | 0.37 |
| ▸ | MMP13 | P45452 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL7806253 | 0.90 | GAA (0.43) | CA2CA1CA12CA9CA3 | |
| SCHEMBL6934729 | 0.89 | CA2 (0.39) | CA2CA1CA12CA9RECQL | |
| SCHEMBL23395839 | 0.89 | CA2 (0.45) | CA2CA1CA12CA9CA3 | |
| SCHEMBL29245112 | 0.89 | CA2 (0.45) | CA2CA1CA12CA9CA3 | |
| Acetone SCHEMBL11517974 | 0.85 | ALDH1A1 (0.41) | CA2CA1RECQLSMN1; SMN2GAA | |
| SCHEMBL21803204 | 0.85 | STAT3 (0.40) | CA2CA1CA12CA9CA3 | |
| SCHEMBL11264990 | 0.84 | GAA (0.38) | CA2CA1CA12CA9CA3 | |
| SCHEMBL3446919 | 0.83 | STAT3 (0.41) | CA2CA1CA12CA9CA3 | |
| SCHEMBL5551724 | 0.82 | PPARG (0.41) | CA2CA1CA12CA9CA3 | |
| SCHEMBL19480330 | 0.82 | GBA1 (0.45) | CA2CA1CA12CA9CA3 |
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-2003097624-A1 | PROCESS FOR PREPARING (R)-3,4-EPOXY-1-BUTANOL | SAMSUNG FINE CHEMICALS CO., LTD. (KR) | 2003-11-27 | — | — | WO | disclosed |