Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.43 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.43 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL31006107 | 0.81 | CYP1A1 (0.59) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL14994072 | 0.81 | CYP1A1 (0.59) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL18904922 | 0.79 | CYP1A1 (0.57) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL19007319 | 0.79 | HSD17B1 (0.32) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL19186073 | 0.73 | CYP1A1 (0.35) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL15004492 | 0.73 | HPRT1 (0.48) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL18904925 | 0.73 | CYP1B1 (0.54) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL1893653 | 0.72 | HSD17B10 (0.41) | CYP1A2CYP1B1 | |
| SCHEMBL15004489 | 0.72 | HPRT1 (0.46) | CYP1A1CYP1A2CYP1B1 | |
| SCHEMBL29396923 | 0.72 | HPRT1 (0.46) | CYP1A1CYP1A2CYP1B1 |
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-2786435-B1 | Compounds | NOVALED GMBH (DE) | 2019-07-17 | — | — | EP | disclosed |