Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DRD2 | P14416 | 13/20 | 0.77 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.77 |
| ▸ | CYP2D6 | P10635 | 3/20 | 0.77 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.77 |
| ▸ | HTR1A | P08908 | 2/20 | 0.77 |
| ▸ | ADRA2A | P08913 | 2/20 | 0.77 |
| ▸ | CHRM1 | P11229 | 2/20 | 0.77 |
| ▸ | ADRA2B | P18089 | 2/20 | 0.77 |
| ▸ | ADRA2C | P18825 | 2/20 | 0.77 |
| ▸ | CHRM3 | P20309 | 2/20 | 0.77 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.77 |
| ▸ | HTR2A | P28223 | 2/20 | 0.77 |
| ▸ | SLC6A4 | P31645 | 2/20 | 0.77 |
| ▸ | ADRA1A | P35348 | 2/20 | 0.77 |
| ▸ | HRH1 | P35367 | 2/20 | 0.77 |
| ▸ | OPRM1 | P35372 | 2/20 | 0.77 |
| ▸ | DRD3 | P35462 | 2/20 | 0.77 |
| ▸ | HTR2B | P41595 | 2/20 | 0.77 |
| ▸ | SLC6A3 | Q01959 | 2/20 | 0.77 |
| ▸ | KCNH2 | Q12809 | 2/20 | 0.77 |
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 | |
|---|---|---|---|---|
| SCHEMBL9053433 | 0.90 | DRD2 (0.78) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL9053658 | 0.90 | DRD2 (0.82) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL9050989 | 0.87 | DRD2 (0.77) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL20653047 | 0.87 | DRD2 (1.00) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| Bromperidol SCHEMBL43755 | 0.87 | DRD2 (1.00) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL8986042 | 0.87 | DRD2 (1.00) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL9053173 | 0.86 | DRD2 (0.82) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| SCHEMBL9052989 | 0.85 | DRD2 (0.74) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| Trifluperidol SCHEMBL120862 | 0.85 | CYP3A4 (1.00) | DRD2CYP3A4CYP2D6CYP1A2HTR1A | |
| Trifluperidol SCHEMBL29710906 | 0.85 | CYP3A4 (1.00) | DRD2CYP3A4CYP2D6CYP1A2HTR1A |
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 |