Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC4 | P56524 | 1/20 | 0.39 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.39 |
| ▸ | ALDH1A1 | P00352 | 3/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.38 |
| ▸ | TP53 | P04637 | 1/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.38 |
| ▸ | S1PR1 | P21453 | 1/20 | 0.38 |
| ▸ | TDP1 | Q9NUW8 | 2/20 | 0.38 |
| ▸ | PABPC1 | P11940 | 1/20 | 0.38 |
| ▸ | EIF4H | Q15056 | 1/20 | 0.38 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.38 |
| ▸ | ITGB2 | P05107 | 1/20 | 0.38 |
| ▸ | ITGAM | P11215 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.37 |
| ▸ | MAPT | P10636 | 1/20 | 0.37 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL20190382 | 0.84 | HDAC4 (0.49) | HDAC4HDAC6ALDH1A1CYP2C19GAA | |
| SCHEMBL20188051 | 0.83 | HDAC4 (0.53) | HDAC4HDAC6ALDH1A1GAAL3MBTL1 | |
| SCHEMBL31704814 | 0.76 | HDAC4 (0.48) | HDAC4HDAC6ALDH1A1CYP2C19TP53 | |
| SCHEMBL23621100 | 0.75 | L3MBTL1 (0.44) | HDAC4HDAC6ALDH1A1CYP2C19TP53 | |
| SCHEMBL3664445 | 0.73 | HDAC4 (0.43) | HDAC4HDAC6ALDH1A1CYP2C19TP53 | |
| SCHEMBL21510768 | 0.71 | S1PR1 (0.53) | ALDH1A1CYP2C19GAAS1PR1TDP1 | |
| SCHEMBL449698 | 0.67 | HDAC4 (0.73) | HDAC4HDAC6ALDH1A1TP53GAA | |
| SCHEMBL28872310 | 0.66 | S1PR1 (0.57) | ALDH1A1S1PR1MEN1MAPTKMT2A | |
| SCHEMBL1801024 | 0.66 | ALDH1A1 (0.65) | HDAC4HDAC6ALDH1A1GAAL3MBTL1 | |
| SCHEMBL25062510 | 0.65 | ALDH1A1 (0.50) | ALDH1A1CYP2C19TP53GAACYP2D6 |
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 |
|---|---|---|---|---|---|---|---|
| EP-3778045-A1 | COMPOUND FOR RESTORING CONTAMINATED SOIL OR CONTAMINATED WATER | FNG Research Co., Ltd. (KR) | 2021-02-17 | — | — | EP | disclosed |