Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.39 |
| ▸ | KISS1R | Q969F8 | 2/20 | 0.31 |
| ▸ | CA2 | P00918 | 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 | |
|---|---|---|---|---|
| SCHEMBL19389343 | 1.00 | ALDH1A1 (0.39) | ALDH1A1TDP1KISS1RCA2 | |
| SCHEMBL18599541 | 0.79 | — | — | |
| SCHEMBL23638159 | 0.70 | ALDH1A1 (0.33) | ALDH1A1TDP1 | |
| SCHEMBL26826782 | 0.70 | ALDH1A1 (0.33) | ALDH1A1TDP1 | |
| SCHEMBL790457 | 0.69 | — | — | |
| SCHEMBL19389324 | 0.69 | ALDH1A1 (0.32) | ALDH1A1TDP1KISS1R | |
| SCHEMBL24126668 | 0.69 | ALDH1A1 (0.32) | ALDH1A1TDP1KISS1R | |
| SCHEMBL21241474 | 0.67 | — | — | |
| SCHEMBL14516064 | 0.67 | — | — | |
| SCHEMBL18953059 | 0.65 | ALDH1A1 (0.43) | ALDH1A1TDP1CA2 |
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-3141252-B1 | INHIBITORS OF INFLUENZA VIRUSES REPLICATION | VERTEX PHARMA (US) | 2018-07-25 | — | — | EP | disclosed |