Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.62 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.53 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.53 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.53 |
| ▸ | TSHR | P16473 | 1/20 | 0.53 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.50 |
| ▸ | USP2 | O75604 | 2/20 | 0.47 |
| ▸ | RAB9A | P51151 | 2/20 | 0.46 |
| ▸ | NPC1 | O15118 | 1/20 | 0.46 |
| ▸ | CHRM2 | P08172 | 1/20 | 0.45 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.45 |
| ▸ | MAPT | P10636 | 2/20 | 0.45 |
| ▸ | ATM | Q13315 | 2/20 | 0.45 |
| ▸ | NPSR1 | Q6W5P4 | 1/20 | 0.45 |
| ▸ | TERT | O14746 | 1/20 | 0.44 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.43 |
| ▸ | HTT | P42858 | 1/20 | 0.43 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.42 |
| ▸ | MEN1 | O00255 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL9768831 | 0.88 | ALDH1A1 (0.56) | TP53CYP3A4CYP2D6ALDH1A1USP2 | |
| SCHEMBL9768740 | 0.88 | CYP2D6 (0.53) | TP53CYP1A2CYP3A4CYP2D6CYP2C19 | |
| Hydrochloric Acid SCHEMBL9768751 | 0.83 | ALDH1A1 (0.44) | TP53CYP3A4CYP2D6TSHRALDH1A1 | |
| SCHEMBL9768785 | 0.77 | NPC1 (0.53) | TP53CYP1A2CYP2C19ALDH1A1RAB9A | |
| SCHEMBL9768832 | 0.75 | MTNR1A (0.40) | TP53CYP1A2CYP3A4CYP2C19MAPT | |
| SCHEMBL9768762 | 0.75 | NPC1 (0.40) | TP53CYP1A2CYP2C19ALDH1A1RAB9A | |
| SCHEMBL9768706 | 0.75 | MAPT (0.44) | TP53CYP1A2CYP2C19ALDH1A1MAPT | |
| SCHEMBL9768744 | 0.73 | NR1I3 (0.44) | TP53CYP2D6TSHRALDH1A1MAPT | |
| SCHEMBL9768823 | 0.73 | KDM4E (0.46) | TP53ALDH1A1MAPTMEN1KMT2A | |
| SCHEMBL9768805 | 0.72 | LMNA (0.46) | TP53CYP1A2CYP3A4CYP2C19TSHR |
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 |
|---|---|---|---|---|---|---|---|
| US-5011833-A | Antidepressant | A. MENARINI INDUSTRIE FARMACEUTICHE RIUNITE (IT) | 1991-04-30 | — | — | US | disclosed |