Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSHR | P16473 | 3/20 | 0.44 |
| ▸ | TRPA1 | O75762 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | MME | P08473 | 1/20 | 0.31 |
| ▸ | ACE | P12821 | 1/20 | 0.31 |
| ▸ | CPA1 | P15085 | 1/20 | 0.31 |
| ▸ | ACE2 | Q9BYF1 | 1/20 | 0.31 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL16280836 | 1.00 | TSHR (0.44) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL106965 | 1.00 | TSHR (0.44) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL16480336 | 1.00 | TSHR (0.44) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL84097 | 0.91 | TSHR (0.42) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL108664 | 0.83 | TSHR (0.53) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL464573 | 0.83 | TSHR (0.53) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL15598284 | 0.83 | TSHR (0.53) | TSHRTRPA1ALDH1A1MMEACE | |
| SCHEMBL16280841 | 0.82 | TSHR (0.40) | TSHRTRPA1TDP1 | |
| SCHEMBL12009798 | 0.82 | TSHR (0.40) | TSHRTRPA1TDP1 | |
| SCHEMBL18951998 | 0.82 | LMNA (0.53) | TSHRTRPA1TDP1 |
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-8691982-B2 | Pyrazolo[1,5-a]-1,3,5-triazine derivatives, preparation thereof, and therapeutic use thereof | CENTRE NATIONAL DE LA RECHERCHE SCIENTIFIQUE (FR) | 2014-04-08 | — | — | US | disclosed |