Predicted protein targets (top 13)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | HSP90AB1 | P08238 | 1/20 | 0.46 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | MPO | P05164 | 2/20 | 0.39 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.37 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.36 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.36 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | POLB | P06746 | 1/20 | 0.34 |
| ▸ | MAPT | P10636 | 1/20 | 0.34 |
| ▸ | TEC | P42680 | 1/20 | 0.33 |
| ▸ | EGLN1 | Q9GZT9 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL11366326 | 0.85 | TLR7 (0.43) | DHFRMPOROCK1L3MBTL1APP | |
| SCHEMBL11376008 | 0.84 | ROCK1 (0.41) | DHFRROCK1ALDH1A1L3MBTL1 | |
| SCHEMBL11375758 | 0.83 | BACE1 (0.47) | DHFRMPOMAP4K4APP | |
| SCHEMBL11377589 | 0.81 | ALDH1A1 (0.49) | DHFRMPOROCK1ALDH1A1POLB | |
| SCHEMBL11365568 | 0.79 | MPO (0.42) | MPOMAP4K4L3MBTL1MAPT | |
| SCHEMBL30996039 | 0.77 | HSP90AB1 (0.47) | HSP90AB1DHFRMPOALDH1A1L3MBTL1 | |
| SCHEMBL11372762 | 0.77 | PNP (0.37) | ROCK1 | |
| SCHEMBL11377984 | 0.74 | TLR8 (0.47) | MPOALDH1A1L3MBTL1 | |
| SCHEMBL11374236 | 0.74 | PARP1 (0.45) | DHFRMAP4K4ROCK1POLB | |
| SCHEMBL11370503 | 0.74 | TLR8 (0.46) | MPOMAP4K4 |
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 4 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-4260759-A | CONDENSATION OF NITRILES | SCHERING-CORPORATION (US) | 1981-04-07 | — | — | US | disclosed |
| US-4115395-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1978-09-19 | — | — | US | disclosed |
| US-4107166-A | ANTIFUNGAL, ANTIBACTERIAL | SCHERING CORPORATION (US) | 1978-08-15 | — | — | US | disclosed |
| US-4017500-A | FUNGICIDES, BACTERICIDES | SCHERING CORPORATION (US) | 1977-04-12 | — | — | US | disclosed |