Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 2/20 | 0.38 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.38 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 4/20 | 0.34 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.34 |
| ▸ | HPGD | P15428 | 1/20 | 0.34 |
| ▸ | LMNA | P02545 | 2/20 | 0.34 |
| ▸ | CLEC4M | Q9H2X3 | 1/20 | 0.34 |
| ▸ | HTR3E | A5X5Y0 | 2/20 | 0.34 |
| ▸ | HTR3B | O95264 | 2/20 | 0.34 |
| ▸ | HTR3A | P46098 | 2/20 | 0.34 |
| ▸ | HTR3D | Q70Z44 | 2/20 | 0.34 |
| ▸ | HTR3C | Q8WXA8 | 2/20 | 0.34 |
| ▸ | MAPT | P10636 | 2/20 | 0.32 |
| ▸ | CNR2 | P34972 | 1/20 | 0.32 |
| ▸ | CRBN | Q96SW2 | 1/20 | 0.32 |
| ▸ | PDK2 | Q15119 | 1/20 | 0.32 |
| ▸ | PDK4 | Q16654 | 1/20 | 0.32 |
| ▸ | GUSB | P08236 | 2/20 | 0.32 |
| ▸ | CHRNA1 | P02708 | 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 | |
|---|---|---|---|---|
| SCHEMBL1556635 | 0.90 | ALDH1A1 (0.45) | CYP1A2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL4723533 | 0.89 | CYP1A2 (0.53) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL7025537 | 0.79 | CYP1A2 (0.56) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL6584701 | 0.77 | HTR3E (0.43) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL7509482 | 0.76 | CYP1A2 (0.53) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL20258340 | 0.76 | CYP1A2 (0.42) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL4765666 | 0.76 | CYP1A2 (0.55) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL7017055 | 0.74 | KDM4E (0.44) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E | |
| SCHEMBL7512756 | 0.74 | ALDH1A1 (0.45) | CYP1A2ALDH1A1KDM4EHPGDLMNA | |
| SCHEMBL7022798 | 0.73 | CYP1A2 (0.49) | CYP3A4CYP1A2CYP2C19ALDH1A1KDM4E |
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-2776431-A1 | 2-OXO-OXAZOLIDIN-3,5-DIYL ANTIBIOTIC DERIVATIVES | Actelion Pharmaceuticals Ltd. (CH) | 2014-09-17 | — | — | EP | disclosed |
| WO-2013068948-A1 | 2-OXO-OXAZOLIDIN-3,5-DIYL ANTIBIOTIC DERIVATIVES | ACTELION PHARMACEUTICALS LTD (CH) | 2013-05-16 | — | — | WO | disclosed |