Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 12/20 | 0.80 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.61 |
| ▸ | ABCB11 | O95342 | 1/20 | 0.61 |
| ▸ | TP53 | P04637 | 1/20 | 0.61 |
| ▸ | PKM | P14618 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | THPO | P40225 | 1/20 | 0.61 |
| ▸ | MTOR | P42345 | 1/20 | 0.61 |
| ▸ | EBP | Q15125 | 1/20 | 0.61 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.60 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.60 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.60 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.59 |
| ▸ | DRD3 | P35462 | 2/20 | 0.55 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.54 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.54 |
| ▸ | HTR1A | P08908 | 1/20 | 0.54 |
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 | |
|---|---|---|---|---|
| SCHEMBL9053173 | 0.92 | DRD2 (0.82) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL8986029 | 0.89 | DRD2 (1.00) | DRD2CYP3A4CYP2D6ABCB11TSHR | |
| SCHEMBL9051380 | 0.87 | DRD2 (0.82) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL9052262 | 0.87 | DRD2 (0.78) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL9055953 | 0.87 | DRD2 (0.78) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL9053433 | 0.87 | DRD2 (0.78) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL8986015 | 0.86 | DRD2 (0.82) | DRD2CYP3A4CYP2D6ABCB11TSHR | |
| SCHEMBL9053428 | 0.85 | DRD2 (0.74) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL9051915 | 0.84 | DRD2 (0.73) | DRD2CYP3A4CYP2D6ABCB11TP53 | |
| SCHEMBL9053345 | 0.84 | ABCB11 (0.85) | DRD2CYP3A4CYP2D6ABCB11TP53 |
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 |
|---|---|---|---|---|---|---|---|
| WO-1996002250-A1 | HALOPERIDOL ANALOGS AND THE USE THEREOF | ACEA PHARMACEUTICALS INC. (US) | 1996-02-01 | — | — | WO | disclosed |