Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 19/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.39 |
| ▸ | FYN | P06241 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL459153 | 0.92 | TTK (0.66) | TTKCYP3A4 | |
| SCHEMBL17590089 | 0.92 | TTK (0.66) | TTKCYP3A4 | |
| SCHEMBL470033 | 0.91 | TTK (0.56) | TTKCYP3A4FYN | |
| SCHEMBL470035 | 0.90 | TTK (0.55) | TTK | |
| SCHEMBL17425399 | 0.88 | TTK (0.64) | TTKCYP3A4 | |
| SCHEMBL455821 | 0.84 | TTK (0.68) | TTK | |
| SCHEMBL17590102 | 0.84 | TTK (0.66) | TTKCYP3A4 | |
| SCHEMBL455615 | 0.83 | TTK (0.68) | TTKCYP3A4 | |
| SCHEMBL470039 | 0.83 | TTK (0.61) | TTK | |
| SCHEMBL456407 | 0.83 | TTK (0.60) | TTK |
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 1 patent. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2012032031-A1 | SUBSTITUTED IMIDAZOPYRIDAZINES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-03-15 | — | — | WO | disclosed |