Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.44 |
| ▸ | MEN1 | O00255 | 2/20 | 0.44 |
| ▸ | GAA | P10253 | 2/20 | 0.44 |
| ▸ | MAPT | P10636 | 2/20 | 0.44 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.44 |
| ▸ | PKM | P14618 | 1/20 | 0.44 |
| ▸ | RECQL | P46063 | 1/20 | 0.44 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.42 |
| ▸ | HSD17B10 | Q99714 | 2/20 | 0.42 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | HSD11B1 | P28845 | 11/20 | 0.41 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.40 |
| ▸ | HPGD | P15428 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.38 |
| ▸ | POLB | P06746 | 1/20 | 0.38 |
| ▸ | RAB9A | P51151 | 1/20 | 0.38 |
| ▸ | GCK | P35557 | 2/20 | 0.38 |
| ▸ | GCKR | Q14397 | 2/20 | 0.38 |
| ▸ | ESR1 | P03372 | 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 | |
|---|---|---|---|---|
| SCHEMBL19179688 | 0.83 | ESR1 (0.46) | ALDH1A1CYP3A4HSD11B1SMN1; SMN2TDP1 | |
| SCHEMBL23155928 | 0.82 | ALDH1A1 (0.48) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL17286682 | 0.82 | ALDH1A1 (0.59) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL13862148 | 0.81 | HSD11B1 (0.44) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL11371728 | 0.81 | SMN1; SMN2 (0.46) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL4598766 | 0.80 | HSD11B1 (0.50) | CYP3A4HSD11B1GCKGCKRAR | |
| SCHEMBL9687133 | 0.79 | ESR1 (0.44) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL29399630 | 0.79 | ESR1 (0.50) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL766058 | 0.79 | ESR1 (0.50) | ALDH1A1MEN1GAAMAPTKMT2A | |
| SCHEMBL29412586 | 0.79 | ESR1 (0.50) | ALDH1A1MEN1GAAMAPTKMT2A |
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-2009107389-A1 | TRICYCLIC COMPOUND | 国立大学法人東京大学 (JP) | 2009-09-03 | — | — | WO | disclosed |