Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | ITK | Q08881 | 9/20 | 0.86 |
| ▸ | EGFR | P00533 | 14/20 | 0.79 |
| ▸ | BTK | Q06187 | 3/20 | 0.63 |
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 | |
|---|---|---|---|---|
| SCHEMBL12518564 | 0.93 | ITK (0.86) | ITKEGFRBTK | |
| SCHEMBL29722293 | 0.93 | ITK (0.86) | ITKEGFRBTK | |
| SCHEMBL12519620 | 0.92 | ITK (1.00) | ITKEGFRBTK | |
| SCHEMBL12519527 | 0.92 | ITK (0.84) | ITKEGFRBTK | |
| SCHEMBL29722483 | 0.89 | EGFR (0.82) | ITKEGFRBTK | |
| SCHEMBL12519536 | 0.89 | EGFR (0.82) | ITKEGFRBTK | |
| SCHEMBL12518557 | 0.89 | EGFR (0.82) | ITKEGFRBTK | |
| SCHEMBL12519782 | 0.89 | EGFR (1.00) | ITKEGFRBTK | |
| SCHEMBL29722242 | 0.89 | EGFR (1.00) | ITKEGFRBTK | |
| SCHEMBL12518581 | 0.88 | ITK (1.00) | ITKEGFRBTK |
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-2519235-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | Avila Therapeutics, Inc. (US) | 2012-11-07 | — | — | EP | disclosed |
| WO-2011090760-A1 | HETEROARYL COMPOUNDS AND USES THEREOF | AVILA THERAPEUTICS, INC. (US) | 2011-07-28 | — | — | WO | disclosed |