Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.53 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 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 | |
|---|---|---|---|---|
| Piperazine SCHEMBL27382581 | 0.88 | CXCR4 (0.41) | ALDH1A1CXCR4SMN1; SMN2 | |
| SCHEMBL2621589 | 0.82 | — | — | |
| SCHEMBL1381471 | 0.80 | — | — | |
| SCHEMBL9623601 | 0.80 | — | — | |
| SCHEMBL17515336 | 0.80 | — | — | |
| SCHEMBL101744 | 0.80 | — | — | |
| SCHEMBL9623851 | 0.80 | — | — | |
| SCHEMBL867332 | 0.80 | — | — | |
| SCHEMBL20549279 | 0.80 | — | — | |
| SCHEMBL9623859 | 0.80 | — | — |
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-9985318-B2 | Electrolyte formulations | WILDCAT DISCOVERY TECHNOLOGIES, INC (US) | 2018-05-29 | — | — | US | disclosed |