Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDM1A | O60341 | 17/20 | 0.52 |
| ▸ | MAOB | P27338 | 15/20 | 0.52 |
| ▸ | MAOA | P21397 | 14/20 | 0.52 |
| ▸ | BRD4 | O60885 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | NPC1 | O15118 | 1/20 | 0.39 |
| ▸ | RAB9A | P51151 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL4331068 | 0.86 | KDM1A (0.67) | KDM1AMAOBMAOA | |
| Ammonia Solution, Strong SCHEMBL11017865 | 0.84 | KDM1A (0.64) | KDM1AMAOBMAOA | |
| Cyanide SCHEMBL27790784 | 0.80 | KDM1A (0.59) | KDM1AMAOBMAOA | |
| SCHEMBL31083620 | 0.78 | KDM1A (0.45) | KDM1AMAOBMAOAALDH1A1NPC1 | |
| Bicarbonate SCHEMBL10984022 | 0.78 | KDM1A (0.57) | KDM1AMAOBMAOA | |
| SCHEMBL10981382 | 0.75 | KDM1A (0.53) | KDM1AMAOBMAOA | |
| SCHEMBL20707753 | 0.75 | MAOB (0.45) | KDM1AMAOBMAOAALDH1A1 | |
| SCHEMBL15604958 | 0.74 | KDM1A (0.47) | KDM1AMAOBMAOA | |
| SCHEMBL25212520 | 0.73 | KDM1A (0.45) | KDM1AMAOBMAOA | |
| SCHEMBL20707745 | 0.73 | KDM1A (0.45) | KDM1AMAOBMAOAALDH1A1 |
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 |
|---|---|---|---|---|---|---|---|
| CN-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | claimed |
| CN-116905005-A | Method for synthesizing 1, 3-oxyfluoride product by electrochemical mode | 南京工业大学 | 2023-10-20 | — | — | CN | disclosed |
| CN-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | disclosed |