Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 3/20 | 0.60 |
| ▸ | EGFR | P00533 | 10/20 | 0.60 |
| ▸ | ITK | Q08881 | 5/20 | 0.60 |
| ▸ | SYK | P43405 | 2/20 | 0.58 |
| ▸ | BTK | Q06187 | 7/20 | 0.56 |
| ▸ | JAK3 | P52333 | 4/20 | 0.56 |
| ▸ | CDK2 | P24941 | 3/20 | 0.55 |
| ▸ | IGF1R | P08069 | 2/20 | 0.55 |
| ▸ | JAK2 | O60674 | 2/20 | 0.55 |
| ▸ | GSK3B | P49841 | 2/20 | 0.55 |
| ▸ | CDK1 | P06493 | 2/20 | 0.55 |
| ▸ | PLK4 | O00444 | 1/20 | 0.55 |
| ▸ | PDPK1 | O15530 | 1/20 | 0.55 |
| ▸ | PRKD3 | O94806 | 1/20 | 0.55 |
| ▸ | MAP4K4 | O95819 | 1/20 | 0.55 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.55 |
| ▸ | INSR | P06213 | 1/20 | 0.55 |
| ▸ | LCK | P06239 | 1/20 | 0.55 |
| ▸ | FYN | P06241 | 1/20 | 0.55 |
| ▸ | FES | P07332 | 1/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL10187818 | 0.91 | AURKA (0.71) | AURKAEGFRITKSYKBTK | |
| SCHEMBL13166254 | 0.84 | AURKA (0.66) | AURKAEGFRITKSYKBTK | |
| SCHEMBL10187765 | 0.81 | JAK2 (0.69) | AURKAEGFRITKSYKBTK | |
| SCHEMBL29695644 | 0.81 | CDK2 (0.64) | AURKAEGFRITKSYKBTK | |
| SCHEMBL270190 | 0.81 | EGFR (0.54) | AURKAEGFRITKSYKBTK | |
| SCHEMBL13166126 | 0.80 | SYK (0.67) | AURKAEGFRITKSYKBTK | |
| SCHEMBL12519548 | 0.80 | SYK (0.67) | AURKAEGFRITKSYKBTK | |
| SCHEMBL12749854 | 0.80 | SYK (0.63) | AURKAEGFRITKSYKBTK | |
| SCHEMBL11919318 | 0.78 | EGFR (0.61) | AURKAEGFRITKSYKBTK | |
| SCHEMBL12519716 | 0.78 | EGFR (0.70) | AURKAEGFRITKSYKBTK |
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 |