Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR1A | P08908 | 6/20 | 0.67 |
| ▸ | HTR7 | P34969 | 4/20 | 0.67 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.61 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | DRD2 | P14416 | 4/20 | 0.59 |
| ▸ | DRD3 | P35462 | 1/20 | 0.59 |
| ▸ | HTR2A | P28223 | 1/20 | 0.58 |
| ▸ | DRD4 | P21917 | 1/20 | 0.58 |
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 | |
|---|---|---|---|---|
| SCHEMBL8980582 | 0.92 | HTR1A (0.62) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL27454683 | 0.90 | KDM4E (0.65) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| Hydrochloric Acid SCHEMBL27508537 | 0.89 | KDM4E (0.64) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL27455347 | 0.85 | MEN1 (0.60) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL3188003 | 0.82 | ALDH1A1 (0.71) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL11446717 | 0.82 | HTR1A (0.75) | HTR1AHTR7DRD2DRD3DRD4 | |
| Hydrochloric Acid SCHEMBL3196115 | 0.81 | HTR1A (0.71) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL6956822 | 0.81 | KDM4E (0.72) | HTR1AHTR7KDM4EALDH1A1TDP1 | |
| SCHEMBL28972654 | 0.80 | DRD2 (0.58) | HTR1AHTR7DRD2DRD3HTR2A | |
| SCHEMBL27470893 | 0.80 | DRD2 (0.59) | HTR1AHTR7KDM4EALDH1A1DRD2 |
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-110511215-B | Aryl piperazine/piperidine compound and application thereof | 复旦大学 | 2023-03-28 | — | — | CN | disclosed |