Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 10/20 | 0.46 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.41 |
| ▸ | LY96 | Q9Y6Y9 | 3/20 | 0.36 |
| ▸ | GBA1 | P04062 | 3/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL12560697 | 1.00 | TLR4 (0.46) | TLR4MAPK1LY96GBA1 | |
| SCHEMBL12560728 | 1.00 | TLR4 (0.46) | TLR4MAPK1LY96GBA1 | |
| SCHEMBL12560681 | 1.00 | TLR4 (0.46) | TLR4MAPK1LY96GBA1 | |
| SCHEMBL12560669 | 0.94 | MAPK1 (0.49) | TLR4MAPK1LY96 | |
| SCHEMBL12560694 | 0.94 | MAPK1 (0.49) | TLR4MAPK1LY96 | |
| SCHEMBL12762965 | 0.94 | MAPK1 (0.49) | TLR4MAPK1LY96 | |
| SCHEMBL12763047 | 0.94 | MAPK1 (0.49) | TLR4MAPK1LY96 | |
| SCHEMBL12600975 | 0.88 | TLR4 (0.45) | TLR4MAPK1LY96 | |
| SCHEMBL12600842 | 0.88 | TLR4 (0.45) | TLR4MAPK1LY96 | |
| SCHEMBL13296777 | 0.86 | MAPK1 (0.42) | TLR4MAPK1LY96 |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| US-7906633-B2 | Reagents and methods for preparing LPS antagonist B1287 and stereoisomers thereof | EISAI R&D MANAGEMENT CO., LTD. (JP) | 2011-03-15 | — | — | US | disclosed |