Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | THPO | P40225 | 1/20 | 0.48 |
| ▸ | LMNA | P02545 | 1/20 | 0.48 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.48 |
| ▸ | AOC3 | Q16853 | 3/20 | 0.41 |
| ▸ | SIGMAR1 | Q99720 | 5/20 | 0.39 |
| ▸ | PPARG | P37231 | 1/20 | 0.39 |
| ▸ | PPARA | Q07869 | 1/20 | 0.39 |
| ▸ | MEN1 | O00255 | 2/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | NPC1 | O15118 | 1/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | HPGD | P15428 | 1/20 | 0.36 |
| ▸ | ALOX15 | P16050 | 1/20 | 0.36 |
| ▸ | CASP3 | P42574 | 1/20 | 0.36 |
| ▸ | RAB9A | P51151 | 1/20 | 0.36 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.36 |
| ▸ | SENP8 | Q96LD8 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL8909812 | 0.85 | CYP2D6 (0.49) | CYP2D6THPOLMNAPMP22AOC3 | |
| SCHEMBL7861690 | 0.73 | CYP2D6 (0.71) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| SCHEMBL19944378 | 0.72 | SIGMAR1 (0.49) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| SCHEMBL19944866 | 0.72 | PARP1 (0.47) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| SCHEMBL19944416 | 0.69 | DRD2 (0.61) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| SCHEMBL6021254 | 0.65 | CYP2D6 (1.00) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| Hydrochloric Acid SCHEMBL2001258 | 0.65 | LMNA (1.00) | CYP2D6THPOLMNAPMP22SIGMAR1 | |
| SCHEMBL27988922 | 0.64 | SIGMAR1 (0.46) | LMNASIGMAR1PPARGPPARAMEN1 | |
| SCHEMBL19944499 | 0.64 | SIGMAR1 (0.47) | SIGMAR1PPARGPPARAMEN1KMT2A | |
| SCHEMBL7860449 | 0.64 | CYP2D6 (0.67) | CYP2D6THPOLMNAPMP22SIGMAR1 |
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-5698565-A | TREATMENT OF PSYCHOTIC DISORDERS | HOFFMANN-LA ROCHE INC. (US) | 1997-12-16 | — | — | US | claimed |