Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 2/20 | 0.59 |
| ▸ | KDM1A | O60341 | 6/20 | 0.51 |
| ▸ | DRD2 | P14416 | 1/20 | 0.51 |
| ▸ | DRD4 | P21917 | 1/20 | 0.51 |
| ▸ | MAOA | P21397 | 4/20 | 0.50 |
| ▸ | MAOB | P27338 | 3/20 | 0.50 |
| ▸ | LTA4H | P09960 | 1/20 | 0.49 |
| ▸ | MEN1 | O00255 | 1/20 | 0.47 |
| ▸ | TSHR | P16473 | 1/20 | 0.47 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.47 |
| ▸ | RAB9A | P51151 | 1/20 | 0.47 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.45 |
| ▸ | HTR2A | P28223 | 1/20 | 0.44 |
| ▸ | HTR2B | P41595 | 1/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL28829908 | 0.84 | HTR2C (0.56) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL22334903 | 0.78 | HTR2C (0.58) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL22335055 | 0.78 | RORC (0.61) | HTR2CKDM1AMAOBHTR2AHTR2B | |
| SCHEMBL22335110 | 0.78 | HTR2C (0.56) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL23995535 | 0.78 | HTR2C (0.69) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL16591278 | 0.78 | HTR2C (0.69) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL31132281 | 0.77 | KDM1A (0.62) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL16585494 | 0.76 | HTR2C (0.67) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL24529204 | 0.76 | HTR2C (0.67) | HTR2CKDM1ADRD2DRD4MAOA | |
| SCHEMBL17985307 | 0.76 | HTR2C (0.67) | HTR2CKDM1ADRD2DRD4MAOA |
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-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | claimed |
| CN-110003110-B | Aryl beta-aminoketone compound and preparation method thereof | 南京工业大学 | 2022-09-06 | — | — | CN | disclosed |