Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | BRD4 | O60885 | 1/20 | 0.31 |
| ▸ | KCNQ3 | O43525 | 1/20 | 0.30 |
| ▸ | KCNQ2 | O43526 | 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 | |
|---|---|---|---|---|
| SCHEMBL2579822 | 0.76 | SMYD3 (0.32) | — | |
| SCHEMBL2595492 | 0.75 | SMN1; SMN2 (0.36) | KCNQ3KCNQ2 | |
| SCHEMBL2596228 | 0.73 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL2593232 | 0.73 | SMN1; SMN2 (0.41) | — | |
| SCHEMBL2596210 | 0.73 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL2595298 | 0.67 | SMN1; SMN2 (0.36) | KCNQ3KCNQ2 | |
| SCHEMBL2596227 | 0.65 | SMN1; SMN2 (0.35) | — | |
| SCHEMBL29250547 | 0.64 | ALDH1A1 (0.45) | — | |
| SCHEMBL3623530 | 0.64 | ALDH1A1 (0.45) | — | |
| SCHEMBL2580221 | 0.63 | TP53 (0.34) | — |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| EP-2569319-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F.HOFFMANN-LA ROCHE AG (CH) | 2013-03-20 | — | — | EP | disclosed |
| WO-2011141396-A1 | HETEROARYL-CYCLOHEXYL-TETRAAZABENZO[E]AZULENES | F. HOFFMANN-LA ROCHE AG (CH) | 2011-11-17 | — | — | WO | disclosed |