Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.31 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.31 |
| ▸ | CA1 | P00915 | 1/20 | 0.30 |
| ▸ | CA2 | P00918 | 1/20 | 0.30 |
| ▸ | CA7 | P43166 | 1/20 | 0.30 |
| ▸ | BTN3A1 | O00481 | 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 | |
|---|---|---|---|---|
| SCHEMBL57651 | 1.00 | AAK1 (0.31) | AAK1HDAC6CA1CA2CA7 | |
| SCHEMBL58272 | 0.85 | AAK1 (0.30) | AAK1 | |
| SCHEMBL90331 | 0.85 | AAK1 (0.30) | AAK1 | |
| SCHEMBL14567873 | 0.83 | HDAC6 (0.31) | HDAC6BTN3A1 | |
| SCHEMBL57627 | 0.81 | TUBB1 (0.33) | AAK1 | |
| SCHEMBL13681924 | 0.81 | — | — | |
| SCHEMBL13446671 | 0.81 | — | — | |
| SCHEMBL4287487 | 0.80 | TUBB1 (0.41) | AAK1 | |
| SCHEMBL12202580 | 0.80 | TUBB1 (0.41) | AAK1 | |
| SCHEMBL4365675 | 0.80 | TUBB1 (0.41) | AAK1 |
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-2374454-A1 | Hemiasterlin derivatives and uses thereof in the treatment of cancer | Eisai R&D Management Co., Ltd. (JP) | 2011-10-12 | — | — | EP | disclosed |