Predicted protein targets (top 16)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 5/20 | 0.53 |
| ▸ | ALDH2 | P05091 | 2/20 | 0.53 |
| ▸ | ALDH3A1 | P30838 | 2/20 | 0.53 |
| ▸ | XIAP | P98170 | 1/20 | 0.45 |
| ▸ | BRD4 | O60885 | 1/20 | 0.43 |
| ▸ | ACHE | P22303 | 1/20 | 0.43 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.43 |
| ▸ | HDAC8 | Q9BY41 | 1/20 | 0.43 |
| ▸ | HDAC6 | Q9UBN7 | 1/20 | 0.43 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
| ▸ | KMT2A | Q03164 | 4/20 | 0.41 |
| ▸ | MEN1 | O00255 | 3/20 | 0.41 |
| ▸ | TP53 | P04637 | 1/20 | 0.41 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.41 |
| ▸ | NPC1 | O15118 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL30489385 | 1.00 | ALDH1A1 (0.53) | ALDH1A1ALDH2ALDH3A1XIAPBRD4 | |
| SCHEMBL28995163 | 0.86 | ALDH1A1 (0.49) | ALDH1A1ALDH2ALDH3A1POLBKMT2A | |
| SCHEMBL28995171 | 0.86 | KMT2A (0.52) | ALDH1A1POLBKMT2AMEN1 | |
| SCHEMBL30489354 | 0.86 | ALDH1A1 (0.49) | ALDH1A1ALDH2ALDH3A1POLBKMT2A | |
| SCHEMBL30489297 | 0.86 | KMT2A (0.52) | ALDH1A1POLBKMT2AMEN1 | |
| SCHEMBL31398271 | 0.85 | PARK7 (0.46) | ALDH1A1ACHEHDAC1HDAC8HDAC6 | |
| SCHEMBL650181 | 0.85 | ALDH1A1 (0.53) | ALDH1A1ALDH2ALDH3A1XIAPBRD4 | |
| SCHEMBL5134148 | 0.85 | ALDH1A1 (0.53) | ALDH1A1ALDH2ALDH3A1XIAPBRD4 | |
| SCHEMBL30489346 | 0.85 | KMT2A (0.47) | POLBKMT2AMEN1SIGMAR1 | |
| SCHEMBL28995172 | 0.85 | KMT2A (0.47) | POLBKMT2AMEN1SIGMAR1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-116043243-A | Method for electrochemically synthesizing 3, 4-dihydro-quinolinone compounds | 桂林电子科技大学 | 2023-05-02 | — | — | CN | disclosed |