Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.31 |
| ▸ | TSHR | P16473 | 2/20 | 0.31 |
| ▸ | LMNA | P02545 | 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 | |
|---|---|---|---|---|
| SCHEMBL2566272 | 0.89 | — | — | |
| Hydrochloric Acid SCHEMBL932736 | 0.86 | — | — | |
| Hydrochloric Acid SCHEMBL15525165 | 0.86 | — | — | |
| Benzene SCHEMBL28041094 | 0.80 | LMNA (0.40) | ALDH1A1TSHRLMNA | |
| Trimethylammonium SCHEMBL6209066 | 0.79 | ALDH1A1 (0.36) | ALDH1A1TSHRLMNA | |
| Trimethylammonium SCHEMBL27511981 | 0.78 | — | — | |
| Chlorethanamine SCHEMBL4944269 | 0.78 | — | — | |
| Trimethylammonium SCHEMBL941893 | 0.78 | — | — | |
| Alcohol SCHEMBL28313309 | 0.75 | TSHR (0.35) | ALDH1A1TSHR | |
| Trimethylammonium SCHEMBL27790470 | 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 |
|---|---|---|---|---|---|---|---|
| US-6350872-B1 | QUATERNARIUM POLYAMINES WITH ANIONS | THE VIRKLER COMPANY | 2002-02-26 | — | — | US | claimed |