Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TLR4 | O00206 | 2/20 | 0.35 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.31 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.30 |
| ▸ | LIPA | P38571 | 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 | |
|---|---|---|---|---|
| SCHEMBL9151877 | 1.00 | TLR4 (0.35) | TLR4CYP1A2CYP2C9LIPA | |
| SCHEMBL9151882 | 1.00 | TLR4 (0.35) | TLR4CYP1A2CYP2C9LIPA | |
| SCHEMBL9151186 | 0.98 | TLR4 (0.36) | TLR4CYP1A2CYP2C9LIPA | |
| SCHEMBL6058639 | 0.98 | TLR4 (0.36) | TLR4CYP1A2CYP2C9LIPA | |
| SCHEMBL9149947 | 0.94 | CYP1A2 (0.34) | CYP1A2CYP2C9LIPA | |
| SCHEMBL9149955 | 0.94 | CYP1A2 (0.34) | CYP1A2CYP2C9LIPA | |
| SCHEMBL24325564 | 0.91 | CYP1A2 (0.36) | CYP1A2CYP2C9LIPA | |
| SCHEMBL21725586 | 0.91 | CYP1A2 (0.36) | CYP1A2CYP2C9LIPA | |
| SCHEMBL15684073 | 0.91 | CYP1A2 (0.36) | CYP1A2CYP2C9LIPA | |
| SCHEMBL12032003 | 0.90 | TLR4 (0.38) | TLR4 |
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 |
|---|---|---|---|---|---|---|---|
| EP-0418362-A1 | TRIFLUOROMETHYLCYCLOHEXANE DERIVATIVES. | MERCK PATENT GMBH (DE) | 1991-03-27 | — | — | EP | disclosed |