Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ACHE | P22303 | 2/20 | 0.54 |
| ▸ | BACE1 | P56817 | 2/20 | 0.54 |
| ▸ | ABCG2 | Q9UNQ0 | 2/20 | 0.52 |
| ▸ | CXCL12 | P48061 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 2/20 | 0.50 |
| ▸ | MAOB | P27338 | 2/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.50 |
| ▸ | MEN1 | O00255 | 1/20 | 0.50 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.50 |
| ▸ | TP53 | P04637 | 1/20 | 0.50 |
| ▸ | MAPT | P10636 | 1/20 | 0.50 |
| ▸ | HPGD | P15428 | 1/20 | 0.50 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.50 |
| ▸ | ALOX12 | P18054 | 1/20 | 0.50 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.50 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.50 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.50 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.50 |
| ▸ | MMP9 | P14780 | 1/20 | 0.49 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL30745497 | 0.90 | MAOB (0.61) | ACHEBACE1MAOAMAOBMEN1 | |
| SCHEMBL30745470 | 0.90 | AR (0.58) | ACHEBACE1ABCG2CXCL12MAOB | |
| SCHEMBL30745430 | 0.90 | ACHE (0.67) | ACHEBACE1ABCG2CXCL12CYP3A4 | |
| SCHEMBL25223485 | 0.84 | CYP3A4 (0.66) | ACHEBACE1ABCG2CXCL12MAOA | |
| SCHEMBL30745476 | 0.81 | MAOB (0.61) | MAOAMAOBMEN1MAPTMAPK1 | |
| SCHEMBL30745426 | 0.81 | MAPT (0.59) | ABCG2CXCL12MAOAMAOBMEN1 | |
| SCHEMBL30745458 | 0.80 | AR (0.57) | ACHEBACE1ABCG2CXCL12MAOB | |
| SCHEMBL30745488 | 0.80 | ACHE (0.65) | ACHEBACE1CXCL12MAOAMAOB | |
| SCHEMBL30745412 | 0.80 | SMN1; SMN2 (0.54) | ACHEBACE1MAOBMAPTSMN1; SMN2 | |
| SCHEMBL30745506 | 0.79 | SMN1; SMN2 (0.53) | ACHEBACE1CXCL12ALDH1A1MAPT |
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 |