Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 1/20 | 0.47 |
| ▸ | NISCH | Q9Y2I1 | 1/20 | 0.47 |
| ▸ | SCN5A | Q14524 | 11/20 | 0.44 |
| ▸ | AURKA | O14965 | 1/20 | 0.44 |
| ▸ | TPX2 | Q9ULW0 | 1/20 | 0.44 |
| ▸ | SCN1A | P35498 | 1/20 | 0.42 |
| ▸ | SCN2A | Q99250 | 1/20 | 0.42 |
| ▸ | MAPT | P10636 | 1/20 | 0.41 |
| ▸ | EPHX2 | P34913 | 1/20 | 0.41 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.41 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | AKR1C2 | P52895 | 1/20 | 0.41 |
| ▸ | AKR1C1 | Q04828 | 1/20 | 0.41 |
| ▸ | GRM2 | Q14416 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL533257 | 1.00 | KIF11 (0.47) | KIF11NISCHSCN5AAURKATPX2 | |
| SCHEMBL41971 | 0.86 | MAPT (0.42) | KIF11NISCHMAPTEPHX2NOTUM | |
| SCHEMBL28109965 | 0.84 | GPR3 (0.42) | KIF11NISCHSCN5AAURKATPX2 | |
| SCHEMBL28046390 | 0.84 | MAPT (0.41) | KIF11NISCHMAPTEPHX2NOTUM | |
| SCHEMBL28513358 | 0.84 | MAPT (0.41) | KIF11NISCHMAPTEPHX2NOTUM | |
| SCHEMBL5542330 | 0.83 | AURKA (0.38) | KIF11NISCHSCN5AAURKATPX2 | |
| SCHEMBL27629692 | 0.83 | KIF11 (0.34) | KIF11NISCHSCN5AAURKATPX2 | |
| SCHEMBL920510 | 0.83 | EPHX2 (0.42) | KIF11NISCHSCN5AMAPTEPHX2 | |
| SCHEMBL28175586 | 0.80 | MAPT (0.42) | NISCHAURKATPX2MAPTEPHX2 | |
| SCHEMBL22344996 | 0.79 | AURKA (0.45) | KIF11NISCHSCN5AAURKATPX2 |
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-1483242-A1 | NITROSODIPHENYLAMINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AGAINST OXIDATIVE STRESS PATHOLOGIES | MERCK PATENT GmbH (DE) | 2004-12-08 | — | — | EP | disclosed |
| WO-2003076406-A1 | NITROSODIPHENYLAMINE DERIVATIVES AND THEIR PHARMACEUTICAL USE AGAINST OXIDATIVE STRESS PATHOLOGIES | MERCK PATENT GMBH (DE) | 2003-09-18 | — | — | WO | disclosed |