Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ESR2 | Q92731 | 3/20 | 0.42 |
| ▸ | CYP2C9 | P11712 | 2/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | LMNA | P02545 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | ESR1 | P03372 | 1/20 | 0.35 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.35 |
| ▸ | PANK3 | Q9H999 | 2/20 | 0.34 |
| ▸ | KDM5A | P29375 | 1/20 | 0.34 |
| ▸ | KDM4C | Q9H3R0 | 1/20 | 0.34 |
| ▸ | KDM5B | Q9UGL1 | 1/20 | 0.34 |
| ▸ | TRPV3 | Q8NET8 | 1/20 | 0.34 |
| ▸ | HTR2A | P28223 | 3/20 | 0.33 |
| ▸ | HTR2C | P28335 | 3/20 | 0.33 |
| ▸ | RORC | P51449 | 1/20 | 0.33 |
| ▸ | HRH3 | Q9Y5N1 | 1/20 | 0.33 |
| ▸ | POLQ | O75417 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL7029269 | 0.92 | CYP2C9 (0.46) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7031709 | 0.92 | ESR2 (0.36) | ESR2CYP2C9ESR1CYP3A4PANK3 | |
| SCHEMBL7020418 | 0.87 | CYP2C9 (0.44) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL18097790 | 0.86 | PANK3 (0.40) | ESR2CYP2C9ESR1CYP3A4PANK3 | |
| SCHEMBL7024984 | 0.86 | ESR2 (0.38) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7024829 | 0.85 | ESR2 (0.39) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7902428 | 0.85 | HTR2A (0.34) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7028218 | 0.85 | CA2 (0.39) | ESR2CYP2C9ESR1CYP3A4PANK3 | |
| SCHEMBL7902427 | 0.85 | HTR2A (0.34) | ESR2CYP2C9ALDH1A1LMNAMAPT | |
| SCHEMBL7902434 | 0.85 | HTR2A (0.34) | ESR2CYP2C9ALDH1A1LMNAMAPT |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-0754668-B1 | Fluorobenzylether derivatives | ROLIC AG (CH) | 2003-02-05 | — | — | EP | disclosed |
| EP-0754668-A2 | Fluorobenzylether derivatives | Rolic AG (CH) | 1997-01-22 | — | — | EP | disclosed |