Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.34 |
| ▸ | GSR | P00390 | 1/20 | 0.32 |
| ▸ | TDP1 | Q9NUW8 | 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 | |
|---|---|---|---|---|
| SCHEMBL22988961 | 0.92 | CYP1A2 (0.39) | CYP1A2GSRTDP1 | |
| SCHEMBL22988943 | 0.88 | CYP1A2 (0.33) | CYP1A2 | |
| SCHEMBL22989088 | 0.87 | ALOX5 (0.33) | CYP1A2 | |
| SCHEMBL22989125 | 0.86 | — | — | |
| SCHEMBL22989064 | 0.85 | LMNA (0.39) | CYP1A2GSRTDP1 | |
| SCHEMBL22989084 | 0.85 | CYP1A2 (0.39) | CYP1A2GSRTDP1 | |
| SCHEMBL22989092 | 0.85 | PRKDC (0.33) | — | |
| SCHEMBL22989037 | 0.82 | PRKDC (0.36) | CYP1A2 | |
| SCHEMBL23031017 | 0.82 | CYP1A2 (0.31) | CYP1A2 | |
| SCHEMBL22989219 | 0.82 | KDM4E (0.40) | CYP1A2GSRTDP1 |
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-2021029757-A1 | NOVEL COMPOUND AND ORGANIC LIGHT EMITTING DEVICE USING SAME | 주식회사 엘지화학 | 2021-02-18 | — | — | WO | disclosed |