Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
| ▸ | HPGD | P15428 | 1/20 | 0.30 |
| ▸ | MAPK1 | P28482 | 1/20 | 0.30 |
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 | |
|---|---|---|---|---|
| SCHEMBL9758782 | 0.96 | NAAA (0.32) | TLR4MAPK1 | |
| SCHEMBL9758283 | 0.95 | NAAA (0.33) | MAPK1 | |
| SCHEMBL9758624 | 0.94 | NAAA (0.34) | ALDH1A1HPGDMAPK1 | |
| SCHEMBL9757776 | 0.94 | TLR4 (0.32) | TLR4MAPK1 | |
| SCHEMBL9758693 | 0.92 | NAAA (0.36) | — | |
| SCHEMBL9759080 | 0.91 | NAAA (0.37) | MAPK1 | |
| SCHEMBL9757754 | 0.90 | MAPK1 (0.36) | TLR4ALDH1A1MAPK1 | |
| SCHEMBL9759646 | 0.89 | PKM (0.33) | HPGDMAPK1 | |
| SCHEMBL9758906 | 0.86 | TLR4 (0.36) | TLR4ALDH1A1 | |
| SCHEMBL9759092 | 0.85 | TP53 (0.34) | ALDH1A1MAPK1 |
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-4985583-A | Liquid Crystals | MERCK PATENT GESELLSCHAFT MIT BESCHRANKTER HAFTUNG (DE) | 1991-01-15 | — | — | US | disclosed |