Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TSPO | P30536 | 5/20 | 0.43 |
| ▸ | PLA2G7 | Q13093 | 8/20 | 0.34 |
| ▸ | CYP3A4 | P08684 | 6/20 | 0.34 |
| ▸ | CYP2D6 | P10635 | 6/20 | 0.34 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.33 |
| ▸ | MAPK14 | Q16539 | 1/20 | 0.33 |
| ▸ | PDE6D | O43924 | 1/20 | 0.32 |
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 | |
|---|---|---|---|---|
| SCHEMBL2317772 | 0.84 | TSPO (0.46) | TSPOPLA2G7PDE6D | |
| SCHEMBL2317766 | 0.84 | TSPO (0.46) | TSPOPLA2G7PDE6D | |
| SCHEMBL4767533 | 0.84 | CES2 (0.45) | SMN1; SMN2 | |
| SCHEMBL4770663 | 0.76 | MCHR1 (0.35) | PLA2G7CYP3A4CYP2D6SMN1; SMN2 | |
| SCHEMBL4777094 | 0.76 | CA12 (0.34) | — | |
| SCHEMBL2321927 | 0.75 | TSPO (0.47) | TSPOPDE6D | |
| SCHEMBL2321922 | 0.75 | TSPO (0.47) | TSPOPDE6D | |
| SCHEMBL4774566 | 0.73 | CES2 (0.46) | SMN1; SMN2 | |
| SCHEMBL2358720 | 0.67 | ELANE (0.49) | — | |
| SCHEMBL2358717 | 0.67 | ELANE (0.49) | — |
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-1902065-A2 | CYCLIC AMIDE DERIVATIVES INHIBITORS OF THE INHIBITOR OF APOPTOSIS PROTEINS, THEIR PREPARATION, AND THEIR USE | Novartis AG (CH) | 2008-03-26 | — | — | EP | claimed |
| WO-2006133147-A2 | ORGANIC COMPOUNDS | NOVARTIS AG (CH) | 2006-12-14 | — | — | WO | claimed |