Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | PTGES | O14684 | 1/20 | 0.43 |
| ▸ | HTR6 | P50406 | 5/20 | 0.41 |
| ▸ | PKLR | P30613 | 1/20 | 0.40 |
| ▸ | PFKFB3 | Q16875 | 1/20 | 0.40 |
| ▸ | ITGB3 | P05106 | 1/20 | 0.40 |
| ▸ | ITGAV | P06756 | 1/20 | 0.40 |
| ▸ | SLC2A1 | P11166 | 1/20 | 0.40 |
| ▸ | GHSR | Q92847 | 1/20 | 0.39 |
| ▸ | IKBKB | O14920 | 1/20 | 0.39 |
| ▸ | HDAC1 | Q13547 | 1/20 | 0.39 |
| ▸ | TP53 | P04637 | 2/20 | 0.38 |
| ▸ | MAPT | P10636 | 2/20 | 0.38 |
| ▸ | GAA | P10253 | 1/20 | 0.38 |
| ▸ | LIMK2 | P53671 | 1/20 | 0.38 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.38 |
| ▸ | NAMPT | P43490 | 1/20 | 0.38 |
| ▸ | IDH2 | P48735 | 1/20 | 0.37 |
| ▸ | PGR | P06401 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL8705122 | 0.95 | HTR6 (0.45) | PTGESHTR6PKLRPFKFB3ITGB3 | |
| SCHEMBL8707148 | 0.89 | KDM4E (0.43) | ITGB3ITGAVGHSRMAPTGAA | |
| SCHEMBL8709540 | 0.89 | ITGB3 (0.43) | ITGB3ITGAV | |
| SCHEMBL8711199 | 0.87 | MRGPRX4 (0.41) | PFKFB3ITGB3ITGAVTP53MAPT | |
| SCHEMBL8714137 | 0.86 | TARS1 (0.45) | PTGESITGB3ITGAVMAPT | |
| SCHEMBL8705895 | 0.86 | ALDH1A1 (0.41) | ITGB3ITGAVGHSRMAPTGAA | |
| SCHEMBL8709447 | 0.85 | ITGB3 (0.48) | PKLRITGB3ITGAVMAPTGAA | |
| SCHEMBL8708878 | 0.85 | LARS1 (0.43) | ITGB3ITGAVGHSRTP53MAPT | |
| SCHEMBL8706016 | 0.84 | NPC1 (0.44) | ITGB3ITGAVMAPTGAASMN1; SMN2 | |
| SCHEMBL8709683 | 0.84 | ITGB3 (0.43) | PKLRITGB3ITGAVHDAC1MAPT |
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 |
|---|---|---|---|---|---|---|---|
| WO-1998041515-A1 | ENDOTHOLIN RECEPTOR ANTAGONISTS | MERCK PATENT GMBH (DE) | 1998-09-24 | — | — | WO | disclosed |