Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP4F2 | P78329 | 3/20 | 0.53 |
| ▸ | CYP4A11 | Q02928 | 3/20 | 0.53 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.48 |
| ▸ | SMN1; SMN2 | Q16637 | 2/20 | 0.48 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.48 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.48 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.48 |
| ▸ | NLRP3 | Q96P20 | 3/20 | 0.47 |
| ▸ | ALOX5 | P09917 | 1/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.42 |
| ▸ | GAA | P10253 | 1/20 | 0.42 |
| ▸ | FAAH | O00519 | 1/20 | 0.42 |
| ▸ | CA1 | P00915 | 1/20 | 0.42 |
| ▸ | CA2 | P00918 | 1/20 | 0.42 |
| ▸ | LMNA | P02545 | 1/20 | 0.42 |
| ▸ | GABRA1 | P14867 | 1/20 | 0.42 |
| ▸ | HPGD | P15428 | 1/20 | 0.42 |
| ▸ | TSHR | P16473 | 1/20 | 0.42 |
| ▸ | GABRB1 | P18505 | 1/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL6902265 | 0.92 | CYP4F2 (0.56) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL6904647 | 0.90 | CYP4F2 (0.51) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL20030391 | 0.87 | CYP4F2 (0.61) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL28072636 | 0.83 | CYP4F2 (0.58) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL4658129 | 0.81 | CYP4F2 (0.48) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL5598458 | 0.81 | MAPK1 (0.46) | CYP4F2CYP4A11CYP1A2CYP3A4NLRP3 | |
| SCHEMBL6902810 | 0.81 | CYP4F2 (0.54) | CYP4F2CYP4A11SMN1; SMN2NLRP3ALDH1A1 | |
| SCHEMBL17284798 | 0.81 | CYP4F2 (0.56) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL27501902 | 0.81 | CYP4F2 (0.56) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 | |
| SCHEMBL6901879 | 0.78 | SLC6A2 (0.42) | CYP4F2CYP4A11CYP1A2CYP3A4SMN1; SMN2 |
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-1430017-A2 | SUBSTITUTED PHENOL COMPOUNDS USEFUL FOR ANESTHESIA AND SEDATION | Theravance, Inc. (US) | 2004-06-23 | — | — | EP | disclosed |
| WO-2003026632-A2 | SUBSTITUTED PHENOL COMPOUNDS USEFUL FOR ANESTHESIA AND SEDATION | THERAVANCE, INC. (US) | 2003-04-03 | — | — | WO | disclosed |