Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR8 | Q9NR97 | 1/20 | 0.46 |
| ▸ | TLR7 | Q9NYK1 | 1/20 | 0.46 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.40 |
| ▸ | PDE10A | Q9Y233 | 3/20 | 0.39 |
| ▸ | NOS3 | P29474 | 5/20 | 0.39 |
| ▸ | NOS2 | P35228 | 5/20 | 0.39 |
| ▸ | NOS1 | P29475 | 2/20 | 0.39 |
| ▸ | LTA4H | P09960 | 1/20 | 0.38 |
| ▸ | LMNA | P02545 | 1/20 | 0.37 |
| ▸ | MPO | P05164 | 1/20 | 0.37 |
| ▸ | F12 | P00748 | 1/20 | 0.37 |
| ▸ | PLAU | P00749 | 1/20 | 0.37 |
| ▸ | NCF1 | P14598 | 1/20 | 0.37 |
| ▸ | BACE1 | P56817 | 1/20 | 0.37 |
| ▸ | HTR6 | P50406 | 1/20 | 0.34 |
| ▸ | TAAR1 | Q96RJ0 | 1/20 | 0.34 |
| ▸ | USP2 | O75604 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL11365568 | 0.83 | MPO (0.42) | MAP4K4NOS3NOS2NOS1LMNA | |
| SCHEMBL11376008 | 0.79 | ROCK1 (0.41) | TLR8TLR7NOS3NOS2NOS1 | |
| SCHEMBL11366326 | 0.77 | TLR7 (0.43) | TLR8TLR7NOS3NOS2LTA4H | |
| SCHEMBL11377984 | 0.75 | TLR8 (0.47) | TLR8TLR7PDE10ALTA4HLMNA | |
| SCHEMBL11374236 | 0.75 | PARP1 (0.45) | TLR8MAP4K4NOS3NOS2NOS1 | |
| SCHEMBL11368123 | 0.74 | HSP90AB1 (0.46) | MAP4K4MPO | |
| SCHEMBL11370420 | 0.72 | DHFR (0.56) | TLR8TLR7NOS1BACE1 | |
| SCHEMBL9390374 | 0.72 | NOS3 (0.59) | MAP4K4NOS3NOS2NOS1LTA4H | |
| SCHEMBL11375889 | 0.71 | PIK3CD (0.39) | LMNAHTR6TAAR1 | |
| SCHEMBL11377589 | 0.70 | ALDH1A1 (0.49) | TLR8TLR7PDE10ALTA4HLMNA |
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 |