Predicted protein targets (top 11)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 3/20 | 0.37 |
| ▸ | SCN9A | Q15858 | 3/20 | 0.33 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.32 |
| ▸ | MAOA | P21397 | 1/20 | 0.32 |
| ▸ | MAOB | P27338 | 1/20 | 0.32 |
| ▸ | ROCK1 | Q13464 | 2/20 | 0.32 |
| ▸ | NR1H4 | Q96RI1 | 1/20 | 0.31 |
| ▸ | WNT3A | P56704 | 1/20 | 0.30 |
| ▸ | MAPT | P10636 | 1/20 | 0.30 |
| ▸ | BRD4 | O60885 | 1/20 | 0.30 |
| ▸ | ATAD2 | Q6PL18 | 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 | |
|---|---|---|---|---|
| SCHEMBL19257825 | 0.84 | SCN9A (0.43) | ITKSCN9AKCNH2MAOAMAOB | |
| SCHEMBL24795655 | 0.83 | ITK (0.35) | ITKSCN9AKCNH2MAOAMAOB | |
| SCHEMBL19258217 | 0.82 | PRKDC (0.36) | ITKKCNH2MAPT | |
| SCHEMBL19258281 | 0.80 | PSMB5 (0.35) | SCN9AKCNH2 | |
| SCHEMBL26783764 | 0.79 | ROCK1 (0.36) | SCN9AMAOAROCK1WNT3A | |
| SCHEMBL24795327 | 0.77 | ITK (0.32) | ITKROCK1 | |
| SCHEMBL25443790 | 0.76 | — | — | |
| SCHEMBL19257828 | 0.76 | ROCK1 (0.34) | SCN9AMAOAROCK1WNT3A | |
| SCHEMBL26064460 | 0.76 | RAB9A (0.39) | ITKKCNH2ROCK1MAPT | |
| SCHEMBL25518903 | 0.76 | PRKDC (0.32) | ITKKCNH2 |
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-3205658-A1 | ORGANIC ELECTROLUMINESCENT MATERIALS AND DEVICES | Universal Display Corporation (US) | 2017-08-16 | — | — | EP | disclosed |