Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CHRNB2 | P17787 | 8/20 | 0.67 |
| ▸ | CHRNA4 | P43681 | 8/20 | 0.67 |
| ▸ | CHRNA7 | P36544 | 7/20 | 0.61 |
| ▸ | CYP2A6 | P11509 | 4/20 | 0.59 |
| ▸ | MEN1 | O00255 | 2/20 | 0.59 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.59 |
| ▸ | CYP2C19 | P33261 | 2/20 | 0.59 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.59 |
| ▸ | POLB | P06746 | 1/20 | 0.59 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.59 |
| ▸ | CYP1A2 | P05177 | 1/20 | 0.59 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.59 |
| ▸ | CYP11B2 | P19099 | 1/20 | 0.45 |
| ▸ | CHRNA3 | P32297 | 2/20 | 0.44 |
| ▸ | CHRNA1 | P02708 | 1/20 | 0.44 |
| ▸ | CHRNG | P07510 | 1/20 | 0.44 |
| ▸ | CHRNB1 | P11230 | 1/20 | 0.44 |
| ▸ | CHRNB4 | P30926 | 1/20 | 0.44 |
| ▸ | CHRND | Q07001 | 1/20 | 0.44 |
| ▸ | KDM1A | O60341 | 1/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL27732325 | 0.83 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL27712170 | 0.83 | CHRNB2 (0.56) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL29411316 | 0.82 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL5912286 | 0.82 | CHRNB2 (0.69) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL24365527 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL5054915 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL4195137 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL9158920 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL13744292 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 | |
| SCHEMBL9158907 | 0.81 | SLC18A3 (0.39) | CHRNB2CHRNA4CHRNA7CYP2A6MEN1 |
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 3 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| CN-1419545-A | 3-cyanoquinolines, 3-cyano-1,6-naphthyridines, and 3-cyano-1,7-naphthyridines as protein kinase inhibitors | WYETH CORP (US) | 2003-05-21 | — | — | CN | disclosed |
| EP-1268431-A1 | 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS | Wyeth (US) | 2003-01-02 | — | — | EP | disclosed |
| WO-2001072711-A1 | 3-CYANOQUINOLINES,3-CYANO-1,6-NAPHTHYRIDINES, AND 3-CYANO-1,7-NAPHTHYRIDINES AS PROTEIN KINASE INHIBITORS | WYETH (US) | 2001-10-04 | — | — | WO | disclosed |