Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR2C | P28335 | 1/20 | 0.56 |
| ▸ | DRD2 | P14416 | 2/20 | 0.49 |
| ▸ | DRD4 | P21917 | 2/20 | 0.49 |
| ▸ | KDM1A | O60341 | 4/20 | 0.49 |
| ▸ | MAOA | P21397 | 2/20 | 0.48 |
| ▸ | MAOB | P27338 | 2/20 | 0.48 |
| ▸ | LTA4H | P09960 | 1/20 | 0.46 |
| ▸ | RAB9A | P51151 | 1/20 | 0.45 |
| ▸ | SOAT1 | P35610 | 1/20 | 0.44 |
| ▸ | DRD3 | P35462 | 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 | |
|---|---|---|---|---|
| SCHEMBL17346802 | 0.92 | HTR2C (0.61) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL18906092 | 0.87 | HTR2C (0.55) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL28829927 | 0.84 | HTR2C (0.59) | HTR2CDRD2DRD4KDM1AMAOA | |
| Ammonia Solution, Strong SCHEMBL5834701 | 0.82 | HTR2C (0.55) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL22335047 | 0.80 | HTR2C (0.54) | HTR2CKDM1AMAOB | |
| SCHEMBL6250305 | 0.78 | HTR2C (0.63) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL6056591 | 0.76 | HTR2C (0.61) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL23995535 | 0.75 | HTR2C (0.69) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL16591278 | 0.75 | HTR2C (0.69) | HTR2CDRD2DRD4KDM1AMAOA | |
| SCHEMBL28829902 | 0.75 | HTR2C (0.59) | HTR2CDRD2DRD4KDM1AMAOA |
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 |