Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A1 | P04798 | 1/20 | 0.33 |
| ▸ | CYP1B1 | Q16678 | 1/20 | 0.33 |
| ▸ | PRKDC | P78527 | 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 | |
|---|---|---|---|---|
| SCHEMBL20363742 | 0.90 | CYP1A1 (0.31) | CYP1A1CYP1B1PRKDC | |
| SCHEMBL24582133 | 0.81 | CYP1A1 (0.42) | CYP1A1CYP1B1 | |
| SCHEMBL16067797 | 0.81 | PRKDC (0.30) | PRKDC | |
| SCHEMBL13508007 | 0.81 | CYP1A1 (0.43) | CYP1A1CYP1B1 | |
| SCHEMBL19108562 | 0.81 | HCRTR1 (0.31) | CYP1A1CYP1B1 | |
| SCHEMBL13509059 | 0.80 | PSD (0.31) | PRKDC | |
| SCHEMBL26308383 | 0.80 | CYP1A1 (0.34) | CYP1A1CYP1B1PRKDC | |
| SCHEMBL26645976 | 0.79 | PRKDC (0.33) | CYP1A1CYP1B1PRKDC | |
| SCHEMBL16067699 | 0.79 | CYP1A1 (0.42) | CYP1A1CYP1B1 | |
| SCHEMBL19108746 | 0.78 | HCRTR1 (0.32) | — |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018128470-A1 | ORGANIC ELECTROLUMINESCENT ELEMENT | 머티어리얼사이언스 주식회사 | 2018-07-12 | — | — | WO | disclosed |