Predicted protein targets (top 1)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 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 | |
|---|---|---|---|---|
| SCHEMBL9759349 | 1.00 | TLR4 (0.33) | TLR4 | |
| SCHEMBL9759355 | 1.00 | TLR4 (0.33) | TLR4 | |
| SCHEMBL9758257 | 0.89 | CYP1A2 (0.34) | TLR4 | |
| SCHEMBL9758261 | 0.89 | CYP1A2 (0.34) | TLR4 | |
| SCHEMBL9758268 | 0.89 | CYP1A2 (0.34) | TLR4 | |
| SCHEMBL9758128 | 0.89 | TLR4 (0.34) | TLR4 | |
| SCHEMBL9758125 | 0.89 | TLR4 (0.34) | TLR4 | |
| SCHEMBL9758134 | 0.89 | TLR4 (0.34) | TLR4 | |
| SCHEMBL9758553 | 0.88 | CYP1A2 (0.37) | — | |
| SCHEMBL9758549 | 0.88 | CYP1A2 (0.37) | — |
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 2 patents. 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 |
| EP-0154849-A2 | Cyclohexane derivatives | MERCK PATENT GmbH (DE) | 1985-09-18 | — | — | EP | disclosed |