Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.39 |
| ▸ | TSHR | P16473 | 1/20 | 0.39 |
| ▸ | SIGMAR1 | Q99720 | 1/20 | 0.38 |
| ▸ | LSS | P48449 | 3/20 | 0.36 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.35 |
| ▸ | DNM1 | Q05193 | 3/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.33 |
| ▸ | KDM1A | O60341 | 1/20 | 0.32 |
| ▸ | EHMT2 | Q96KQ7 | 1/20 | 0.32 |
| ▸ | RCOR1 | Q9UKL0 | 1/20 | 0.32 |
| ▸ | ATP1A1 | P05023 | 1/20 | 0.30 |
| ▸ | ATP1B1 | P05026 | 1/20 | 0.30 |
| ▸ | ATP1A3 | P13637 | 1/20 | 0.30 |
| ▸ | ATP1B2 | P14415 | 1/20 | 0.30 |
| ▸ | ATP1A2 | P50993 | 1/20 | 0.30 |
| ▸ | ATP1B3 | P54709 | 1/20 | 0.30 |
| ▸ | FXYD2 | P54710 | 1/20 | 0.30 |
| ▸ | ATP1A4 | Q13733 | 1/20 | 0.30 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.30 |
| ▸ | HTR2A | P28223 | 1/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL78257 | 0.85 | SLC6A2 (0.33) | HRH3SLC6A2HTR2AHTR2CSLC6A4 | |
| Hydrochloric Acid SCHEMBL5035531 | 0.83 | LSS (0.46) | LSS | |
| Hydrochloric Acid SCHEMBL5635365 | 0.83 | SLC6A2 (0.33) | HRH3SLC6A2HTR2AHTR2CSLC6A4 | |
| Hydrochloric Acid SCHEMBL1873378 | 0.83 | SLC6A2 (0.33) | HRH3SLC6A2HTR2AHTR2CSLC6A4 | |
| SCHEMBL6448156 | 0.83 | ALDH1A1 (0.36) | ALDH1A1BCHEACHE | |
| SCHEMBL6449276 | 0.80 | LSS (0.51) | LSS | |
| SCHEMBL20487794 | 0.79 | GNAO1 (0.46) | ALDH1A1 | |
| SCHEMBL6132345 | 0.79 | SLC6A4 (0.34) | ALDH1A1SLC6A2HTR2AHTR2CSLC6A4 | |
| SCHEMBL9741247 | 0.79 | GNAO1 (0.46) | ALDH1A1 | |
| SCHEMBL6132360 | 0.79 | SLC6A4 (0.34) | ALDH1A1SLC6A2HTR2AHTR2CSLC6A4 |
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-6964974-B2 | 2,3-oxidosqualene-lanosterol cyclase inhibitors | HOFFMANN-LA ROCHE INC. (US) | 2005-11-15 | — | — | US | disclosed |