Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | EGFR | P00533 | 20/20 | 0.70 |
| ▸ | ERBB2 | P04626 | 15/20 | 0.70 |
| ▸ | ERBB4 | Q15303 | 5/20 | 0.70 |
| ▸ | GAK | O14976 | 1/20 | 0.67 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.67 |
| ▸ | NR1I2 | O75469 | 1/20 | 0.67 |
| ▸ | LCK | P06239 | 1/20 | 0.67 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.67 |
| ▸ | CHRM1 | P11229 | 1/20 | 0.67 |
| ▸ | SRC | P12931 | 1/20 | 0.67 |
| ▸ | DRD2 | P14416 | 1/20 | 0.67 |
| ▸ | ADRA2C | P18825 | 1/20 | 0.67 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.67 |
| ▸ | MC3R | P41968 | 1/20 | 0.67 |
| ▸ | JAK3 | P52333 | 1/20 | 0.67 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.67 |
| ▸ | PDE4D | Q08499 | 1/20 | 0.67 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.67 |
| ▸ | RIPK3 | Q9Y572 | 1/20 | 0.67 |
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 | |
|---|---|---|---|---|
| SCHEMBL1919941 | 1.00 | EGFR (0.70) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL29623479 | 0.94 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL185348 | 0.94 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL230985 | 0.94 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL1191587 | 0.92 | EGFR (0.77) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL185032 | 0.92 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL231418 | 0.92 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL29623448 | 0.92 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL14427865 | 0.91 | EGFR (0.78) | EGFRERBB2ERBB4GAKRIPK2 | |
| SCHEMBL3578549 | 0.91 | EGFR (0.74) | EGFRERBB2ERBB4GAKRIPK2 |
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-2393492-A1 | NEW PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OF RESPIRATORY AND GASTROINTESTINAL DISORDERS | Boehringer Ingelheim International GmbH (DE) | 2011-12-14 | — | — | EP | disclosed |
| WO-2010089391-A1 | NEW PHARMACEUTICAL COMPOSITIONS FOR TREATMENT OF RESPIRATORY AND GASTROINTESTINAL DISORDERS | BOEHRINGER INGELHEIM INTERNATIONAL GMBH (DE) | 2010-08-12 | — | — | WO | disclosed |