Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA1 | P00915 | 3/20 | 0.34 |
| ▸ | CA2 | P00918 | 1/20 | 0.34 |
| ▸ | FDPS | P14324 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL26274110 | 0.69 | CA1 (0.39) | CA1CA2FDPS | |
| SCHEMBL3482730 | 0.68 | CA1 (0.35) | CA1FDPS | |
| SCHEMBL13075358 | 0.68 | CTSK (0.40) | CA1CA2FDPS | |
| SCHEMBL17327494 | 0.68 | CTSK (0.40) | CA1CA2FDPS | |
| SCHEMBL28263192 | 0.68 | CA1 (0.52) | CA1FDPS | |
| SCHEMBL20792042 | 0.66 | CA1 (0.50) | CA1FDPS | |
| Hexane SCHEMBL17422136 | 0.66 | CA2 (0.42) | CA1CA2 | |
| SCHEMBL3481782 | 0.66 | CA1 (0.33) | CA1CA2FDPS | |
| SCHEMBL1285149 | 0.65 | — | — | |
| SCHEMBL23260653 | 0.64 | CA1 (0.35) | CA1CA2FDPS |
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-2019136145-A1 | PRINS REACTION AND COMPOUNDS USEFUL IN THE SYNTHESIS OF HALICHONDRIN MACROLIDES AND ANALOGS THEREOF | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2019-07-11 | — | — | WO | disclosed |