Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.41 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.39 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.39 |
| ▸ | HDAC2 | Q92769 | 1/20 | 0.39 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.39 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.39 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.39 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.39 |
| ▸ | FFAR1 | O14842 | 1/20 | 0.38 |
| ▸ | HPGD | P15428 | 3/20 | 0.38 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.38 |
| ▸ | HSD17B10 | Q99714 | 1/20 | 0.38 |
| ▸ | CYSLTR2 | Q9NS75 | 2/20 | 0.38 |
| ▸ | CYSLTR1 | Q9Y271 | 2/20 | 0.38 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.36 |
| ▸ | PTGS2 | P35354 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL9505512 | 0.64 | CYSLTR2 (0.70) | ALDH1A1CYSLTR2CYSLTR1MAPT | |
| SCHEMBL5081086 | 0.64 | ALDH1A1 (0.85) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL8088391 | 0.64 | ALDH1A1 (0.85) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL7820281 | 0.64 | ALDH1A1 (0.85) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3943933 | 0.64 | ALDH1A1 (0.85) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL710248 | 0.64 | ALDH1A1 (0.85) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL3947072 | 0.64 | ALDH1A1 (0.57) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5169003 | 0.63 | ALDH1A1 (0.74) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL5167895 | 0.63 | ALDH1A1 (0.74) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 | |
| SCHEMBL2351099 | 0.63 | ALDH1A1 (0.89) | ALDH1A1HDAC3HDAC4HDAC1HDAC7 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0548291-A1 | PYRIDYLTHIO OR PYRIDYLOXY ALKANOIC ACIDS | SMITHKLINE BEECHAM CORPORATION (US) | 1993-06-30 | — | — | EP | disclosed |
| WO-1992005156-A1 | PYRIDYLTHIO OR PYRIDYLOXY ALKANOIC ACIDS | SMITHKLINE BEECHAM CORPORATION (US) | 1992-04-02 | — | — | WO | disclosed |