Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC6 | Q9UBN7 | 10/20 | 0.66 |
| ▸ | HDAC1 | Q13547 | 10/20 | 0.66 |
| ▸ | HSP90AA1 | P07900 | 9/20 | 0.66 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.66 |
| ▸ | HDAC7 | Q8WUI4 | 4/20 | 0.66 |
| ▸ | HDAC8 | Q9BY41 | 6/20 | 0.58 |
| ▸ | KDM1A | O60341 | 4/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.53 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
| ▸ | CYP3A43 | Q9HB55 | 1/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 3/20 | 0.51 |
| ▸ | HDAC11 | Q96DB2 | 3/20 | 0.51 |
| ▸ | HDAC9 | Q9UKV0 | 3/20 | 0.51 |
| ▸ | HDAC5 | Q9UQL6 | 3/20 | 0.51 |
| ▸ | HDAC2 | Q92769 | 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 | |
|---|---|---|---|---|
| SCHEMBL29200006 | 0.87 | HSP90AA1 (0.70) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL21644656 | 0.85 | SMN1; SMN2 (0.53) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL21644655 | 0.84 | HSP90AA1 (0.64) | HSP90AA1CYP3A4CYP2C9CYP2C19 | |
| SCHEMBL29244988 | 0.80 | HSP90AA1 (1.00) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL29244999 | 0.78 | HSP90AA1 (1.00) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL21644589 | 0.77 | HSP90AA1 (0.48) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL30779607 | 0.77 | HSP90AA1 (0.48) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL29245128 | 0.76 | HSP90AA1 (1.00) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL29244960 | 0.75 | HSP90AA1 (0.72) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 | |
| SCHEMBL30277511 | 0.75 | HSP90AA1 (0.72) | HDAC6HDAC1HSP90AA1HDAC3HDAC7 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-4399198-A2 | DUAL INHIBITOR OF HISTONE DEACETYLASE 6 AND HEAT SHOCK PROTEIN 90 | Taipei Medical University (TW) | 2024-07-17 | — | — | EP | disclosed |
| WO-2023035005-A2 | DUAL INHIBITOR OF HISTONE DEACETYLASE 6 AND HEAT SHOCK PROTEIN 90 | TAIPEI MEDICAL UNIVERSITY (TW) | 2023-03-09 | — | — | WO | disclosed |
| WO-2023035005-A2 | DUAL INHIBITOR OF HISTONE DEACETYLASE 6 AND HEAT SHOCK PROTEIN 90 | TAIPEI MEDICAL UNIVERSITY (TW) | 2023-03-09 | — | — | WO | disclosed |