Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ROCK2 | O75116 | 4/20 | 0.62 |
| ▸ | ROCK1 | Q13464 | 4/20 | 0.62 |
| ▸ | EGFR | P00533 | 3/20 | 0.59 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.57 |
| ▸ | LMNA | P02545 | 2/20 | 0.55 |
| ▸ | HPGD | P15428 | 1/20 | 0.54 |
| ▸ | SENP1 | Q9P0U3 | 1/20 | 0.54 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.52 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.52 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.52 |
| ▸ | HDAC6 | Q9UBN7 | 2/20 | 0.52 |
| ▸ | HDAC3 | O15379 | 1/20 | 0.52 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.52 |
| ▸ | HDAC7 | Q8WUI4 | 1/20 | 0.52 |
| ▸ | HDAC10 | Q969S8 | 1/20 | 0.52 |
| ▸ | HDAC11 | Q96DB2 | 1/20 | 0.52 |
| ▸ | HDAC9 | Q9UKV0 | 1/20 | 0.52 |
| ▸ | HDAC5 | Q9UQL6 | 1/20 | 0.52 |
| ▸ | POLB | P06746 | 1/20 | 0.52 |
| ▸ | PRKACA | P17612 | 2/20 | 0.51 |
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 | |
|---|---|---|---|---|
| SCHEMBL3422647 | 0.85 | ROCK2 (0.62) | ROCK2ROCK1EGFRLMNAHPGD | |
| SCHEMBL6185148 | 0.84 | HDAC6 (0.65) | ALOX5LMNAHPGDSENP1HDAC1 | |
| SCHEMBL254400 | 0.83 | ROCK2 (0.62) | ROCK2ROCK1EGFRPRKACAGSK3A | |
| SCHEMBL24628975 | 0.83 | ROCK2 (0.62) | ROCK2ROCK1EGFRHDAC1PRKACA | |
| SCHEMBL26816033 | 0.83 | ROCK2 (0.62) | ROCK2ROCK1EGFRHDAC1HDAC2 | |
| SCHEMBL26844281 | 0.82 | NPC1 (0.53) | ROCK2ROCK1EGFRHDAC1HDAC2 | |
| SCHEMBL24628436 | 0.81 | ROCK2 (0.60) | ROCK2ROCK1EGFRSENP1HDAC1 | |
| SCHEMBL24629269 | 0.80 | ROCK2 (0.58) | ROCK2ROCK1EGFRHDAC1HDAC2 | |
| SCHEMBL254918 | 0.80 | ROCK2 (0.78) | ROCK2ROCK1EGFRSENP1HDAC1 | |
| SCHEMBL4483467 | 0.78 | MMP13 (0.59) | ROCK2ROCK1EGFRHPGDPOLB |
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-4276092-A1 | COMPOUND LIBRARY | CHUGAI SEIYAKU KABUSHIKI KAISHA (JP) | 2023-11-15 | — | — | EP | disclosed |
| WO-2022149617-A1 | COMPOUND LIBRARY | 中外製薬株式会社 | 2022-07-14 | — | — | WO | disclosed |