Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SIGMAR1 | Q99720 | 2/20 | 0.62 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.61 |
| ▸ | MAPT | P10636 | 1/20 | 0.61 |
| ▸ | TSHR | P16473 | 1/20 | 0.61 |
| ▸ | NFKB1 | P19838 | 1/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.61 |
| ▸ | THPO | P40225 | 1/20 | 0.61 |
| ▸ | MTOR | P42345 | 1/20 | 0.61 |
| ▸ | BLM | P54132 | 1/20 | 0.61 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.61 |
| ▸ | TDP1 | Q9NUW8 | 1/20 | 0.61 |
| ▸ | DRD2 | P14416 | 3/20 | 0.57 |
| ▸ | ADRA1A | P35348 | 1/20 | 0.57 |
| ▸ | DRD3 | P35462 | 1/20 | 0.57 |
| ▸ | HTR1A | P08908 | 10/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL9519068 | 0.89 | ALDH1A1 (0.69) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9521505 | 0.88 | DRD2 (0.64) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9520731 | 0.83 | HTR2C (0.74) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL6619322 | 0.81 | ALDH1A1 (0.71) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL9518929 | 0.81 | ALDH1A1 (0.65) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3454609 | 0.78 | SIGMAR1 (1.00) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL11628368 | 0.77 | SMO (0.55) | SIGMAR1ALDH1A1MAPTTSHRTDP1 | |
| SCHEMBL9518927 | 0.77 | HTR1A (0.67) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL3976547 | 0.77 | ALDH1A1 (1.00) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 | |
| SCHEMBL31513986 | 0.77 | ALDH1A1 (1.00) | SIGMAR1ALDH1A1CYP1A2CYP3A4CYP2D6 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0279598-B1 | ARYLPIPERAZINYL-ALKYLENE-PHENYL-HETEROCYCLIC COMPOUNDS | PFIZER INC. (US) | 1993-09-15 | — | — | EP | disclosed |
| US-4891375-A | Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds | PFIZER INC. (US) | 1990-01-02 | — | — | US | disclosed |
| EP-0279598-A2 | Arylpiperazinyl-alkylene-phenyl-heterocyclic compounds | PFIZER INC. (US) | 1988-08-24 | — | — | EP | disclosed |