Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KCNH2 | Q12809 | 14/20 | 0.51 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.42 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.42 |
| ▸ | EGLN1 | Q9GZT9 | 2/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL708597 | 0.84 | KCNH2 (0.51) | KCNH2CYP3A4CYP2D6 | |
| SCHEMBL12002207 | 0.84 | KCNH2 (0.54) | KCNH2 | |
| SCHEMBL706674 | 0.79 | KCNH2 (0.45) | KCNH2CYP3A4CYP2D6EGLN1 | |
| SCHEMBL708368 | 0.78 | KCNH2 (0.56) | KCNH2CYP3A4CYP2D6 | |
| SCHEMBL14679203 | 0.77 | KCNH2 (0.56) | KCNH2CYP3A4CYP2D6 | |
| SCHEMBL14610965 | 0.77 | CDK8 (0.42) | KCNH2EGLN1 | |
| SCHEMBL922035 | 0.77 | KCNH2 (0.57) | KCNH2CYP3A4CYP2D6 | |
| SCHEMBL12002208 | 0.76 | KCNH2 (0.55) | KCNH2CYP3A4CYP2D6 | |
| SCHEMBL19094697 | 0.76 | KCNH2 (0.49) | KCNH2 | |
| SCHEMBL2797848 | 0.75 | KCNH2 (0.56) | KCNH2 |
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-2468743-A1 | Nitrogen-containing bicyclic compounds useful as antibacterial agents | Toyama Chemical Co., Ltd. (JP) | 2012-06-27 | — | — | EP | disclosed |
| EP-1900732-A1 | NOVEL NITROGENATED HETEROCYCLIC COMPOUND AND SALT THEREOF | TOYAMA CHEMICAL CO., LTD. (JP) | 2008-03-19 | — | — | EP | disclosed |