Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HTR5A | P47898 | 1/20 | 0.37 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.33 |
| ▸ | TSHR | P16473 | 1/20 | 0.33 |
| ▸ | DRD2 | P14416 | 1/20 | 0.33 |
| ▸ | DRD3 | P35462 | 1/20 | 0.33 |
| ▸ | HTR1A | P08908 | 1/20 | 0.32 |
| ▸ | ADRA1D | P25100 | 1/20 | 0.32 |
| ▸ | MTNR1A | P48039 | 1/20 | 0.32 |
| ▸ | MTNR1B | P49286 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | MAPT | P10636 | 1/20 | 0.31 |
| ▸ | RAB9A | P51151 | 1/20 | 0.31 |
| ▸ | HTR2A | P28223 | 2/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL11218640 | 0.83 | HTR1A (0.37) | HTR5ASMN1; SMN2CYP2D6TSHRDRD2 | |
| SCHEMBL11225277 | 0.70 | SMN1; SMN2 (0.37) | HTR5ASMN1; SMN2CYP2D6DRD2DRD3 | |
| SCHEMBL11419267 | 0.66 | HTR1A (0.36) | DRD2DRD3HTR1AADRA1D | |
| SCHEMBL11230856 | 0.66 | ALOX5 (0.36) | — | |
| SCHEMBL11233879 | 0.66 | AKT1 (0.30) | — | |
| SCHEMBL11219802 | 0.66 | MAPT (0.33) | HTR1AADRA1DALDH1A1MAPT | |
| SCHEMBL11224396 | 0.65 | SLC6A4 (0.41) | SMN1; SMN2CYP2D6DRD3HTR1AADRA1D | |
| SCHEMBL11247838 | 0.64 | SIGMAR1 (0.41) | ALDH1A1HTR2A | |
| SCHEMBL11229230 | 0.63 | KDM4E (0.38) | HTR1AADRA1DALDH1A1 | |
| SCHEMBL11218655 | 0.63 | — | — |
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-4153612-A | 2-Benzoxepins | THE UPJOHN COMPANY (US) | 1979-05-08 | — | — | US | disclosed |