Predicted protein targets (top 10)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP2C9 | P11712 | 1/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.38 |
| ▸ | MEN1 | O00255 | 1/20 | 0.38 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.38 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.38 |
| ▸ | OPRL1 | P41146 | 5/20 | 0.33 |
| ▸ | ESR2 | Q92731 | 2/20 | 0.33 |
| ▸ | HTT | P42858 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL7030312 | 0.94 | CYP2C9 (0.38) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8385844 | 0.94 | CYP2C9 (0.38) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7032790 | 0.91 | OPRL1 (0.33) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7032814 | 0.87 | CYP1A2 (0.33) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL8387252 | 0.87 | CYP1A2 (0.33) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7031561 | 0.85 | MEN1 (0.33) | CYP2C9MAPTMEN1KMT2AOPRL1 | |
| SCHEMBL8388228 | 0.85 | MEN1 (0.33) | CYP2C9MAPTMEN1KMT2AOPRL1 | |
| SCHEMBL7033151 | 0.85 | CYP2C9 (0.44) | CYP2C9ALDH1A1MAPTLMNAMEN1 | |
| SCHEMBL7027993 | 0.84 | OPRL1 (0.31) | OPRL1 | |
| SCHEMBL7030674 | 0.84 | OPRL1 (0.31) | OPRL1ESR2 |
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 |