Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 2/20 | 0.34 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.34 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.34 |
| ▸ | NCOR2 | Q9Y618 | 1/20 | 0.34 |
| ▸ | CHIT1 | Q13231 | 3/20 | 0.33 |
| ▸ | POLB | P06746 | 1/20 | 0.33 |
| ▸ | GAA | P10253 | 1/20 | 0.33 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.32 |
| ▸ | HPGD | P15428 | 1/20 | 0.32 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.32 |
| ▸ | F2 | P00734 | 1/20 | 0.32 |
| ▸ | PRSS1 | P07477 | 1/20 | 0.32 |
| ▸ | PRSS2 | P07478 | 1/20 | 0.32 |
| ▸ | PRSS3 | P35030 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | FAAH | O00519 | 3/20 | 0.32 |
| ▸ | CES1 | P23141 | 3/20 | 0.32 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.31 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.31 |
| ▸ | HDAC10 | Q969S8 | 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 | |
|---|---|---|---|---|
| Trifluoroacetic Acid SCHEMBL7523050 | 0.75 | MAPK1 (0.49) | HDAC3HDAC1HDAC2CHIT1POLB | |
| Trifluoroacetic Acid SCHEMBL8649110 | 0.71 | EPHX2 (0.40) | POLBGAA | |
| Trifluoroacetic Acid SCHEMBL30465005 | 0.70 | FAAH (0.41) | ALDH1A1FAAHCES1HDAC6 | |
| SCHEMBL8283680 | 0.70 | MEN1 (0.42) | HDAC3HDAC1HDAC2POLBGAA | |
| SCHEMBL11065271 | 0.69 | EPHX2 (0.50) | POLBALDH1A1HPGDHSD17B10FAAH | |
| SCHEMBL15641739 | 0.68 | HPGD (0.48) | POLBALDH1A1HPGDHSD17B10 | |
| SCHEMBL27861312 | 0.68 | MTNR1A (0.40) | HDAC3HDAC1HDAC2NCOR2GAA | |
| Trifluoroacetic Acid SCHEMBL6155593 | 0.68 | KEAP1 (0.59) | HDAC3HDAC1HDAC2POLBGAA | |
| SCHEMBL16539268 | 0.67 | SIRT2 (0.48) | GAAALDH1A1HPGDHSD17B10TDP1 | |
| Trifluoroacetic Acid SCHEMBL30882532 | 0.66 | CES1 (0.60) | HDAC3HDAC1HDAC2FAAHCES1 |
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-2002016314-A1 | SUBSTITUTED POLYAMINE COMPOUNDS | H. LUNDBECK A/S (DK) | 2002-02-28 | — | — | WO | disclosed |