Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | SIRT2 | Q8IXJ6 | 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 | |
|---|---|---|---|---|
| SCHEMBL21698375 | 0.86 | PARP1 (0.32) | ALDH1A1 | |
| SCHEMBL21698374 | 0.77 | PARP1 (0.32) | — | |
| SCHEMBL17457731 | 0.76 | SIRT2 (0.36) | ALDH1A1SIRT2 | |
| SCHEMBL16119445 | 0.76 | SIRT2 (0.36) | ALDH1A1SIRT2 | |
| SCHEMBL21698361 | 0.76 | NAMPT (0.30) | ALDH1A1 | |
| SCHEMBL21698406 | 0.76 | — | — | |
| SCHEMBL21698368 | 0.76 | SMYD3 (0.30) | — | |
| SCHEMBL23837340 | 0.75 | HPGD (0.33) | ALDH1A1 | |
| SCHEMBL21698403 | 0.74 | ALDH1A1 (0.33) | ALDH1A1 | |
| SCHEMBL21698409 | 0.74 | — | — |
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-2970340-B1 | BETA-LACTAMASE INHIBITORS | VENATORX PHARMACEUTICALS INC (US) | 2020-02-12 | — | — | EP | disclosed |