Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NAAA | Q02083 | 1/20 | 0.34 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.30 |
| ▸ | LMNA | P02545 | 1/20 | 0.30 |
| ▸ | TP53 | P04637 | 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 | |
|---|---|---|---|---|
| SCHEMBL6952064 | 0.76 | NAAA (0.41) | NAAATRPA1ALDH1A1LMNATP53 | |
| SCHEMBL25333725 | 0.68 | — | — | |
| SCHEMBL4779439 | 0.67 | — | — | |
| SCHEMBL347269 | 0.67 | NAAA (0.32) | NAAATRPA1 | |
| SCHEMBL44443 | 0.64 | — | — | |
| SCHEMBL12079899 | 0.63 | NAAA (0.38) | NAAATRPA1 | |
| SCHEMBL25332876 | 0.63 | — | — | |
| Ethyl Isothiocyanate SCHEMBL287524 | 0.62 | — | — | |
| SCHEMBL5993562 | 0.62 | NAAA (0.32) | NAAATRPA1 | |
| SCHEMBL11339733 | 0.62 | TRPA1 (0.35) | NAAATRPA1ALDH1A1LMNATP53 |
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 |
|---|---|---|---|---|---|---|---|
| CN-104520309-A | N-substituted second generation derivatives of antifungal antibiotic amphotericin B and methods of their preparation and application | BLIRT SA | 2015-04-15 | — | — | CN | disclosed |