Predicted protein targets (top 2)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP1A2 | P05177 | 1/20 | 0.32 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.31 |
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 | |
|---|---|---|---|---|
| SCHEMBL31272326 | 0.84 | KDM4E (0.35) | CYP1A2 | |
| SCHEMBL25311047 | 0.81 | HTT (0.38) | CYP1A2ALDH1A1 | |
| SCHEMBL31272578 | 0.76 | NR1H2 (0.49) | CYP1A2 | |
| SCHEMBL31272354 | 0.75 | CYP1A2 (0.34) | CYP1A2 | |
| SCHEMBL17723529 | 0.71 | NPC1 (0.35) | CYP1A2 | |
| SCHEMBL4264509 | 0.67 | HTT (0.38) | ALDH1A1 | |
| SCHEMBL31272606 | 0.66 | CYP1A2 (0.72) | CYP1A2ALDH1A1 | |
| SCHEMBL25311372 | 0.66 | ALDH1A1 (0.41) | CYP1A2ALDH1A1 | |
| SCHEMBL1930807 | 0.65 | — | — | |
| SCHEMBL3299167 | 0.62 | — | — |
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-3212635-B1 | ENERGETIC COMPOUNDS AND COMPOSITIONS | TECH INNOVATION MOMENTUM FUND ISREAL LIMITED PARTNERSHIP (IL) | 2020-04-22 | — | — | EP | disclosed |