Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TP53 | P04637 | 1/20 | 0.47 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.46 |
| ▸ | GMNN | O75496 | 1/20 | 0.46 |
| ▸ | LMNA | P02545 | 1/20 | 0.46 |
| ▸ | MAPT | P10636 | 1/20 | 0.46 |
| ▸ | BLM | P54132 | 1/20 | 0.46 |
| ▸ | PMP22 | Q01453 | 1/20 | 0.46 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.46 |
| ▸ | SLC1A3 | P43003 | 6/20 | 0.42 |
| ▸ | SLC1A2 | P43004 | 6/20 | 0.42 |
| ▸ | SLC1A1 | P43005 | 6/20 | 0.42 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.40 |
| ▸ | EPHX1 | P07099 | 1/20 | 0.38 |
| ▸ | DPP4 | P27487 | 1/20 | 0.38 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.37 |
| ▸ | USP2 | O75604 | 1/20 | 0.36 |
| ▸ | SLCO1B1 | Q9Y6L6 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL3586116 | 0.81 | TP53 (0.50) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL3579526 | 0.79 | TP53 (0.47) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL17784381 | 0.79 | TP53 (0.56) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL5907847 | 0.75 | EPHX1 (0.45) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL24520314 | 0.75 | EPHX1 (0.45) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL24548559 | 0.75 | EPHX1 (0.45) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL5907851 | 0.75 | EPHX1 (0.45) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL24520302 | 0.75 | EPHX1 (0.45) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL10701343 | 0.74 | ALDH1A1 (0.42) | TP53KDM4EGMNNLMNAMAPT | |
| SCHEMBL24520309 | 0.72 | SLC1A3 (0.50) | SLC1A3SLC1A2SLC1A1ALDH1A1EPHX1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0443560-A2 | HIV protease inhibitors | BIO-MEGA/BOEHRINGER INGELHEIM RESEARCH INC. (CA) | 1991-08-28 | — | — | EP | disclosed |