Predicted protein targets (top 8)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | SLC6A4 | P31645 | 5/20 | 0.59 |
| ▸ | SLC6A3 | Q01959 | 5/20 | 0.59 |
| ▸ | SLC6A2 | P23975 | 2/20 | 0.54 |
| ▸ | HSD11B1 | P28845 | 10/20 | 0.53 |
| ▸ | HDAC4 | P56524 | 1/20 | 0.46 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.43 |
| ▸ | P2RX7 | Q99572 | 1/20 | 0.43 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.40 |
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 | |
|---|---|---|---|---|
| SCHEMBL10695332 | 0.85 | HSD11B1 (0.73) | SLC6A4SLC6A3SLC6A2HSD11B1 | |
| SCHEMBL12836593 | 0.85 | SLC6A3 (0.62) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL3633468 | 0.84 | HSD11B1 (0.68) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL16430484 | 0.83 | P2RX7 (0.54) | SLC6A4SLC6A3HSD11B1ALDH1A1P2RX7 | |
| SCHEMBL12836588 | 0.83 | SLC6A4 (0.59) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL2644998 | 0.82 | DPP4 (0.53) | SLC6A4SLC6A3SLC6A2HSD11B1ALDH1A1 | |
| SCHEMBL624643 | 0.81 | HSD11B1 (0.63) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL12894890 | 0.80 | SLC6A4 (0.51) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL11104354 | 0.79 | SLC6A4 (0.50) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 | |
| SCHEMBL12836587 | 0.79 | SLC6A4 (0.54) | SLC6A4SLC6A3SLC6A2HSD11B1HDAC4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0272580-A2 | Liquidcrystalline cyclohexylbenzene derivatives their manufacturing and novel nematic admixtures containing same | Wojskowa Akademia Techniczna im. Jaroslawa Dabrowskiego (PL) | 1988-06-29 | — | — | EP | disclosed |