Predicted protein targets (top 5)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.36 |
| ▸ | FEN1 | P39748 | 2/20 | 0.33 |
| ▸ | NOS1 | P29475 | 1/20 | 0.31 |
| ▸ | NOS2 | P35228 | 1/20 | 0.31 |
| ▸ | ALOX5AP | P20292 | 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 | |
|---|---|---|---|---|
| SCHEMBL29324373 | 0.93 | FEN1 (0.34) | FEN1ALOX5AP | |
| SCHEMBL29324712 | 0.88 | CYP1A2 (0.35) | CYP1A2FEN1 | |
| SCHEMBL29324365 | 0.88 | FEN1 (0.36) | FEN1ALOX5AP | |
| SCHEMBL9405941 | 0.88 | ESR2 (0.36) | CYP1A2NOS1NOS2 | |
| SCHEMBL9419301 | 0.84 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL9406033 | 0.84 | ESR2 (0.35) | CYP1A2 | |
| SCHEMBL9419260 | 0.83 | CTSL (0.34) | — | |
| SCHEMBL9419285 | 0.83 | MEN1 (0.31) | — | |
| SCHEMBL29324433 | 0.83 | CEL (0.36) | CYP1A2 | |
| SCHEMBL9406214 | 0.82 | ESR2 (0.34) | CYP1A2 |
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-4400561-A1 | LIQUID-CRYSTAL MEDIUM | Merck Patent GmbH (DE) | 2024-07-17 | — | — | EP | disclosed |