Predicted protein targets (top 18)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | AURKA | O14965 | 1/20 | 0.47 |
| ▸ | RPS6KB1 | P23443 | 1/20 | 0.47 |
| ▸ | HTR1B | P28222 | 4/20 | 0.47 |
| ▸ | BCDIN3D | Q7Z5W3 | 1/20 | 0.38 |
| ▸ | IDO1 | P14902 | 2/20 | 0.37 |
| ▸ | CDK9 | P50750 | 1/20 | 0.37 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.37 |
| ▸ | EPM2A | O95278 | 1/20 | 0.37 |
| ▸ | PTPRC | P08575 | 1/20 | 0.37 |
| ▸ | PTPN6 | P29350 | 1/20 | 0.37 |
| ▸ | CDC14A | Q9UNH5 | 1/20 | 0.37 |
| ▸ | PTPN22 | Q9Y2R2 | 1/20 | 0.37 |
| ▸ | CTNNB1 | P35222 | 2/20 | 0.37 |
| ▸ | WNT3A | P56704 | 2/20 | 0.37 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.37 |
| ▸ | MEN1 | O00255 | 1/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 1/20 | 0.36 |
| ▸ | MAPT | P10636 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL2936741 | 0.79 | AURKA (0.48) | AURKARPS6KB1HTR1BIDO1EPM2A | |
| SCHEMBL12773613 | 0.79 | AURKA (0.48) | AURKARPS6KB1HTR1BEPM2APTPRC | |
| SCHEMBL13073662 | 0.78 | ALDH1A1 (0.51) | AURKARPS6KB1HTR1BCTNNB1WNT3A | |
| SCHEMBL16596460 | 0.76 | AURKA (0.46) | AURKARPS6KB1HTR1BIDO1CTNNB1 | |
| SCHEMBL1254685 | 0.75 | HTR1B (0.61) | AURKARPS6KB1HTR1BBCDIN3DDYRK1A | |
| SCHEMBL14470249 | 0.75 | HTR1B (0.53) | AURKARPS6KB1HTR1BBCDIN3DIDO1 | |
| SCHEMBL13034791 | 0.75 | ERCC1 (0.56) | AURKARPS6KB1HTR1BCTNNB1WNT3A | |
| SCHEMBL6562324 | 0.73 | IDO1 (0.64) | IDO1CYP2A6MAPT | |
| SCHEMBL12773619 | 0.73 | HTR1B (0.45) | AURKARPS6KB1HTR1BCTNNB1WNT3A | |
| SCHEMBL5809234 | 0.72 | CTNNB1 (0.48) | AURKARPS6KB1HTR1BEPM2APTPRC |
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-1709040-A2 | FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE | Sirenade Pharmaceuticals AG (DE) | 2006-10-11 | — | — | EP | disclosed |
| WO-2005068458-A2 | FIVE-MEMBERED HETEROCYCLIC COMPOUNDS AS INHIBITORS OF SRC FAMILY PROTEIN KINASE | SIRENADE PHARMACEUTICALS AG (DE) | 2005-07-28 | — | — | WO | disclosed |