Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BCHE | P06276 | 12/20 | 0.53 |
| ▸ | CES2 | O00748 | 1/20 | 0.48 |
| ▸ | SERPINE1 | P05121 | 3/20 | 0.47 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.46 |
| ▸ | IGF1R | P08069 | 1/20 | 0.46 |
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.45 |
| ▸ | PTPN1 | P18031 | 1/20 | 0.45 |
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 | |
|---|---|---|---|---|
| SCHEMBL19903744 | 0.84 | SERPINE1 (0.63) | BCHESERPINE1DYRK1AIGF1RHSP90AB1 | |
| SCHEMBL19903720 | 0.81 | SERPINE1 (0.55) | BCHESERPINE1DYRK1AIGF1RHSP90AB1 | |
| SCHEMBL19903731 | 0.81 | SERPINE1 (0.55) | BCHESERPINE1DYRK1AIGF1RHSP90AB1 | |
| SCHEMBL19903721 | 0.78 | SERPINE1 (0.55) | BCHESERPINE1DYRK1AIGF1RHSP90AB1 | |
| SCHEMBL11298564 | 0.78 | BCHE (0.80) | BCHECES2 | |
| SCHEMBL15442485 | 0.77 | BCHE (0.70) | BCHECES2 | |
| SCHEMBL3181386 | 0.75 | BCHE (0.70) | BCHECES2 | |
| SCHEMBL12860944 | 0.75 | BCHE (0.70) | BCHECES2 | |
| SCHEMBL7145226 | 0.73 | BCHE (0.78) | BCHECES2 | |
| SCHEMBL15845097 | 0.73 | BCHE (0.78) | BCHECES2 |
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-3287462-A1 | ISOSORBIDE DERIVATIVES TO TREAT BACTERIAL BIOFILMS | NITTO DENKO CORPORATION (JP) | 2018-02-28 | — | — | EP | disclosed |