Predicted protein targets (top 6)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KIF11 | P52732 | 11/20 | 0.85 |
| ▸ | CASP3 | P42574 | 1/20 | 0.66 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.66 |
| ▸ | MAOB | P27338 | 4/20 | 0.62 |
| ▸ | AOC1 | P19801 | 2/20 | 0.62 |
| ▸ | MAOA | P21397 | 2/20 | 0.60 |
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 | |
|---|---|---|---|---|
| SCHEMBL3627575 | 0.92 | KIF11 (1.00) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL4321033 | 0.92 | KIF11 (1.00) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL3626545 | 0.86 | KIF11 (0.80) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL3627291 | 0.83 | KIF11 (0.65) | KIF11AOC1 | |
| SCHEMBL3621249 | 0.83 | KIF11 (0.80) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL3621868 | 0.81 | KIF11 (1.00) | KIF11CASP3KCNH2MAOB | |
| SCHEMBL3620962 | 0.81 | KIF11 (1.00) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL3614709 | 0.80 | KIF11 (1.00) | KIF11MAOB | |
| SCHEMBL17151556 | 0.79 | KIF11 (1.00) | KIF11CASP3KCNH2MAOBAOC1 | |
| SCHEMBL3625650 | 0.79 | KIF11 (1.00) | KIF11CASP3KCNH2MAOBAOC1 |
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 |
|---|---|---|---|---|---|---|---|
| US-7745639-B2 | Mitotic kinesin inhibitors | MERCK & CO., INC. (US) | 2010-06-29 | — | — | US | claimed |
| EP-1492487-B1 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2009-11-11 | — | — | EP | claimed |
| EP-1492487-B1 | MITOTIC KINESIN INHIBITORS | MERCK & CO INC (US) | 2009-11-11 | — | — | EP | disclosed |