Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC1 | Q13547 | 3/20 | 0.57 |
| ▸ | HDAC6 | Q9UBN7 | 3/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.57 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.57 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.57 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.57 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.57 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.57 |
| ▸ | HDAC8 | Q9BY41 | 2/20 | 0.57 |
| ▸ | HDAC9 | Q9UKV0 | 2/20 | 0.57 |
| ▸ | HDAC5 | Q9UQL6 | 2/20 | 0.57 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.46 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.46 |
| ▸ | RAB9A | P51151 | 3/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.46 |
| ▸ | HPGD | P15428 | 3/20 | 0.46 |
| ▸ | PKM | P14618 | 2/20 | 0.46 |
| ▸ | TP53 | P04637 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 2/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
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 | |
|---|---|---|---|---|
| SCHEMBL18573582 | 0.83 | PTPN1 (0.63) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL18573584 | 0.81 | CDC7 (0.60) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL18573643 | 0.81 | RAB9A (0.60) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL6246566 | 0.80 | PLA2G10 (0.59) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL18573455 | 0.79 | RAB9A (0.62) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL23048444 | 0.79 | HDAC3 (0.50) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL3748204 | 0.75 | HDAC6 (0.60) | HDAC6ALDH1A1KDM4ERAB9AMAPK1 | |
| SCHEMBL18573457 | 0.75 | PTPN1 (0.63) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL18573578 | 0.74 | HDAC3 (0.53) | HDAC1HDAC6HDAC3HDAC4HDAC7 | |
| SCHEMBL16702935 | 0.74 | SMN1; SMN2 (0.47) | HDAC1HDAC6ALDH1A1KDM4ERAB9A |
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-3339299-B1 | NOVEL CATECHOL DERIVATIVE AND PHARMACEUTICAL COMPOSITION COMPRISING SAME | AUTOPHAGYSCIENCES INC (KR) | 2021-03-03 | — | — | EP | claimed |