Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.56 |
| ▸ | PAOX | Q6QHF9 | 4/20 | 0.47 |
| ▸ | MAOA | P21397 | 1/20 | 0.46 |
| ▸ | MAOB | P27338 | 1/20 | 0.46 |
| ▸ | CA12 | O43570 | 3/20 | 0.43 |
| ▸ | CA2 | P00918 | 3/20 | 0.43 |
| ▸ | CA4 | P22748 | 3/20 | 0.43 |
| ▸ | CA6 | P23280 | 3/20 | 0.43 |
| ▸ | CA5A | P35218 | 3/20 | 0.43 |
| ▸ | CA7 | P43166 | 3/20 | 0.43 |
| ▸ | CA9 | Q16790 | 3/20 | 0.43 |
| ▸ | CA14 | Q9ULX7 | 3/20 | 0.43 |
| ▸ | CA5B | Q9Y2D0 | 3/20 | 0.43 |
| ▸ | CA3 | P07451 | 2/20 | 0.43 |
| ▸ | F13A1 | P00488 | 2/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.43 |
| ▸ | THPO | P40225 | 2/20 | 0.43 |
| ▸ | CA1 | P00915 | 1/20 | 0.43 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL31581884 | 1.00 | HDAC6 (0.56) | HDAC6PAOXMAOAMAOBCA12 | |
| Trifluoroacetic Acid SCHEMBL8501095 | 0.88 | HDAC6 (0.58) | HDAC6PAOXCA12CA2CA4 | |
| Spermine SCHEMBL3134527 | 0.85 | HDAC6 (0.67) | HDAC6PAOXMAOAMAOBCA12 | |
| Spermine SCHEMBL674873 | 0.85 | HDAC6 (0.67) | HDAC6PAOXMAOAMAOBCA12 | |
| Trifluoroacetic Acid SCHEMBL5344960 | 0.83 | PAOX (0.45) | PAOXCA12CA2CA4CA6 | |
| Trifluoroacetic Acid SCHEMBL5548189 | 0.82 | HDAC6 (0.54) | HDAC6PAOXMAOAMAOBCA12 | |
| Dodecylamine SCHEMBL23001137 | 0.81 | DNM1 (0.56) | CYP1A2TSHREPHX1MEN1KMT2A | |
| Decylamine SCHEMBL28610774 | 0.81 | DNM1 (0.56) | CYP1A2TSHREPHX1MEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL28868688 | 0.81 | DNM1 (0.56) | CYP1A2TSHREPHX1MEN1KMT2A | |
| Trifluoroacetic Acid SCHEMBL29282412 | 0.81 | DNM1 (0.56) | CYP1A2TSHREPHX1MEN1KMT2A |
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 |
|---|---|---|---|---|---|---|---|
| WO-2025106386-A1 | A CYCLIC PEPTIDE FOR TRAPPING INTERLEUKIN-1 BETA | MERCK SHARP & DOHME LLC (US) | 2025-05-22 | — | — | WO | disclosed |