Predicted protein targets (top 12)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.40 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.40 |
| ▸ | F2 | P00734 | 2/20 | 0.37 |
| ▸ | PRSS1 | P07477 | 2/20 | 0.37 |
| ▸ | PRSS2 | P07478 | 2/20 | 0.37 |
| ▸ | PRSS3 | P35030 | 2/20 | 0.37 |
| ▸ | CA1 | P00915 | 2/20 | 0.36 |
| ▸ | CA2 | P00918 | 2/20 | 0.36 |
| ▸ | CA7 | P43166 | 1/20 | 0.36 |
| ▸ | CA13 | Q8N1Q1 | 1/20 | 0.36 |
| ▸ | TP53 | P04637 | 1/20 | 0.32 |
| ▸ | TSHR | P16473 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| Trifluoromethanesulfonic Acid SCHEMBL2863042 | 0.83 | ALDH1A1 (0.43) | ALDH1A1L3MBTL1F2PRSS1PRSS2 | |
| Trifluoromethanesulfonic Acid SCHEMBL9901215 | 0.83 | ALDH1A1 (0.48) | ALDH1A1L3MBTL1F2PRSS1PRSS2 | |
| Trifluoromethanesulfonic Acid SCHEMBL20661176 | 0.81 | ALDH1A1 (0.56) | ALDH1A1L3MBTL1CA1CA2CA7 | |
| Trifluoromethanesulfonic Acid SCHEMBL31399915 | 0.80 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL2154008 | 0.80 | — | — | |
| Trifluoromethanesulfonic Acid SCHEMBL27903142 | 0.78 | BLM (0.47) | ALDH1A1L3MBTL1F2PRSS1PRSS2 | |
| Trifluoroacetamide SCHEMBL20915034 | 0.77 | ALDH1A1 (0.39) | ALDH1A1CA2TP53TSHR | |
| Trifluoromethanesulfonic Acid SCHEMBL31758571 | 0.76 | CA1 (0.50) | ALDH1A1L3MBTL1F2PRSS1PRSS2 | |
| Trifluoromethanesulfonic Acid SCHEMBL5551810 | 0.76 | CA1 (0.50) | ALDH1A1L3MBTL1F2PRSS1PRSS2 | |
| SCHEMBL30995902 | 0.76 | ALDH1A1 (0.50) | ALDH1A1CA2TP53TSHR |
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-6239265-B1 | FOR RESEARCH AND DIAGNOSIS | ISIS PHARMACEUTICALS, INC. | 2001-05-29 | — | — | US | disclosed |