Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR7 | Q9NYK1 | 4/20 | 0.43 |
| ▸ | TLR8 | Q9NR97 | 3/20 | 0.43 |
| ▸ | DHFR | P00374 | 1/20 | 0.43 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.41 |
| ▸ | LTA4H | P09960 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.35 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.34 |
| ▸ | APP | P05067 | 1/20 | 0.34 |
| ▸ | NOS3 | P29474 | 3/20 | 0.33 |
| ▸ | NOS2 | P35228 | 3/20 | 0.33 |
| ▸ | NOTUM | Q6P988 | 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 | |
|---|---|---|---|---|
| SCHEMBL11368123 | 0.85 | HSP90AB1 (0.46) | DHFRROCK1MPOL3MBTL1APP | |
| SCHEMBL11376008 | 0.84 | ROCK1 (0.41) | TLR7TLR8DHFRROCK1LTA4H | |
| SCHEMBL11377589 | 0.84 | ALDH1A1 (0.49) | TLR7TLR8DHFRROCK1LTA4H | |
| SCHEMBL11377984 | 0.83 | TLR8 (0.47) | TLR7TLR8LTA4HMPOL3MBTL1 | |
| SCHEMBL11374236 | 0.77 | PARP1 (0.45) | TLR8DHFRROCK1NOS3NOS2 | |
| SCHEMBL11372762 | 0.77 | PNP (0.37) | ROCK1NOS3NOS2 | |
| SCHEMBL11370503 | 0.77 | TLR8 (0.46) | TLR7TLR8LTA4HMPONOS3 | |
| SCHEMBL11561502 | 0.75 | TLR7 (0.44) | TLR7TLR8DHFRLTA4HAPP | |
| SCHEMBL11375758 | 0.74 | BACE1 (0.47) | DHFRMPOAPP | |
| SCHEMBL18564375 | 0.72 | PDE10A (0.45) | TLR7TLR8L3MBTL1APP |
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 |