Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 1/20 | 0.43 |
| ▸ | DRD1 | P21728 | 1/20 | 0.43 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.34 |
| ▸ | CYP1A1 | P04798 | 1/20 | 0.34 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | CYP2E1 | P05181 | 1/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.34 |
| ▸ | CYP2C8 | P10632 | 1/20 | 0.34 |
| ▸ | CYP2A6 | P11509 | 1/20 | 0.34 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.34 |
| ▸ | CYP4B1 | P13584 | 1/20 | 0.34 |
| ▸ | CYP2B6 | P20813 | 1/20 | 0.34 |
| ▸ | CYP3A5 | P20815 | 1/20 | 0.34 |
| ▸ | CYP2A7 | P20853 | 1/20 | 0.34 |
| ▸ | CYP3A7 | P24462 | 1/20 | 0.34 |
| ▸ | CYP2F1 | P24903 | 1/20 | 0.34 |
| ▸ | CYP2C18 | P33260 | 1/20 | 0.34 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.34 |
| ▸ | CYP2J2 | P51589 | 1/20 | 0.34 |
| ▸ | CXCR4 | P61073 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL22245280 | 0.77 | DRD2 (0.47) | DRD2DRD1CYP2D6CYP19A1PDK2 | |
| SCHEMBL30309386 | 0.74 | DRD2 (0.36) | DRD2DRD1CYP2D6CYP1A1CYP1A2 | |
| SCHEMBL27932286 | 0.73 | DRD2 (0.41) | DRD2DRD1CYP19A1PDK2TBXAS1 | |
| SCHEMBL17781829 | 0.73 | DRD2 (0.41) | DRD2DRD1CYP2D6CYP19A1TBXAS1 | |
| SCHEMBL13245792 | 0.70 | DRD2 (0.42) | DRD2DRD1ALDH1A1TBXAS1 | |
| SCHEMBL3360708 | 0.69 | CYP2D6 (0.38) | DRD2CYP2D6CYP3A4CYP2C8CYP2C19 | |
| SCHEMBL4864016 | 0.69 | DRD2 (0.33) | DRD2DRD1 | |
| SCHEMBL1567832 | 0.67 | HTR2A (0.46) | CYP2D6CYP3A4 | |
| SCHEMBL17760134 | 0.67 | HTR2C (0.42) | DRD2DRD1HTR1ASLC6A2SLC6A4 | |
| SCHEMBL5187232 | 0.67 | DRD2 (0.39) | DRD2DRD1CYP2D6CYP3A4CYP19A1 |
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-6458168-B1 | Hair dyeing method using an aliphatic cationic amine and compound chosen from an aldehyde, a ketone, a quinone, a di-imino-isoindoline, and a 3-aminoisoindolone derivative | L'OREAL S.A. (FR) | 2002-10-01 | — | — | US | claimed |