Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CA2 | P00918 | 4/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.30 |
| ▸ | GAA | P10253 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
| ▸ | NPSR1 | Q6W5P4 | 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 | |
|---|---|---|---|---|
| SCHEMBL16382514 | 1.00 | CA2 (0.34) | CA2POLBGAAMAPK1NPSR1 | |
| SCHEMBL16385802 | 0.87 | CA2 (0.32) | CA2POLBGAAMAPK1NPSR1 | |
| SCHEMBL13825698 | 0.85 | CA2 (0.31) | CA2 | |
| SCHEMBL16602868 | 0.85 | CA2 (0.31) | CA2 | |
| SCHEMBL12432517 | 0.85 | CA2 (0.31) | CA2 | |
| SCHEMBL10099915 | 0.76 | CA2 (0.31) | CA2 | |
| SCHEMBL15785728 | 0.76 | CA2 (0.31) | CA2 | |
| SCHEMBL20402011 | 0.75 | CA2 (0.32) | CA2POLBGAAMAPK1NPSR1 | |
| SCHEMBL15249666 | 0.74 | CA2 (0.32) | CA2 | |
| SCHEMBL10099912 | 0.74 | CA2 (0.32) | CA2 |
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 |
|---|---|---|---|---|---|---|---|
| US-RE46965-E1 | Intermediates for the preparation of analogs of Halichondrin B | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2018-07-24 | — | — | US | disclosed |