Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HDAC3 | O15379 | 3/20 | 0.55 |
| ▸ | HDAC1 | Q13547 | 3/20 | 0.55 |
| ▸ | HDAC2 | Q92769 | 3/20 | 0.55 |
| ▸ | HDAC8 | Q9BY41 | 3/20 | 0.55 |
| ▸ | CTSL | P07711 | 2/20 | 0.53 |
| ▸ | MAOB | P27338 | 4/20 | 0.53 |
| ▸ | MEN1 | O00255 | 1/20 | 0.53 |
| ▸ | LMNA | P02545 | 1/20 | 0.53 |
| ▸ | MAPT | P10636 | 1/20 | 0.53 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.53 |
| ▸ | CYP1B1 | Q16678 | 2/20 | 0.49 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.49 |
| ▸ | TUBB4A | P04350 | 1/20 | 0.48 |
| ▸ | TUBB | P07437 | 1/20 | 0.48 |
| ▸ | TUBA3C | P0DPH7 | 1/20 | 0.48 |
| ▸ | TUBA1B | P68363 | 1/20 | 0.48 |
| ▸ | TUBA4A | P68366 | 1/20 | 0.48 |
| ▸ | TUBB4B | P68371 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL30745460 | 0.91 | HDAC3 (0.53) | HDAC3HDAC1HDAC2HDAC8MAOB | |
| SCHEMBL30745481 | 0.90 | MAOB (0.53) | HDAC3HDAC1HDAC2HDAC8MAOB | |
| SCHEMBL30745452 | 0.88 | MEN1 (0.52) | HDAC3HDAC1HDAC2HDAC8MAOB | |
| SCHEMBL30745447 | 0.81 | ACHE (0.60) | HDAC3HDAC1HDAC2HDAC8CTSL | |
| SCHEMBL30745507 | 0.79 | CTSL (0.59) | CTSLMAOBMEN1LMNAMAPT | |
| SCHEMBL5517451 | 0.79 | MAOB (0.67) | CTSLMAOBMEN1LMNAMAPT | |
| SCHEMBL5517453 | 0.79 | MAOB (0.67) | CTSLMAOBMEN1LMNAMAPT | |
| SCHEMBL30745464 | 0.77 | CTSL (0.57) | CTSLMAOBMEN1LMNAMAPT | |
| SCHEMBL30745465 | 0.75 | CTSL (0.54) | CTSLMAOBMEN1LMNAMAPT | |
| SCHEMBL30745473 | 0.74 | CTSL (0.53) | CTSLMAOBMEN1LMNAMAPT |
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 |
|---|---|---|---|---|---|---|---|
| CN-117567303-A | Chalcone Mannich base compound, pharmaceutical composition, preparation method and application thereof | 安徽中医药大学 | 2024-02-20 | — | — | CN | claimed |
| CN-117567303-A | Chalcone Mannich base compound, pharmaceutical composition, preparation method and application thereof | 安徽中医药大学 | 2024-02-20 | — | — | CN | disclosed |