Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 20/20 | 0.81 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.53 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.53 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.53 |
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 | |
|---|---|---|---|---|
| SCHEMBL457795 | 0.95 | TTK (0.81) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL15556070 | 0.93 | TTK (0.82) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL457024 | 0.92 | TTK (0.83) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL17425436 | 0.90 | TTK (0.80) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL455987 | 0.90 | TTK (0.80) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL455434 | 0.90 | TTK (0.66) | TTKCYP3A4 | |
| SCHEMBL17416370 | 0.89 | TTK (0.65) | TTK | |
| SCHEMBL17416396 | 0.89 | TTK (0.69) | TTK | |
| SCHEMBL15556740 | 0.87 | TTK (0.77) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL458987 | 0.87 | TTK (0.77) | TTKCYP3A4CYP2C9CYP2C19 |
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-2614063-A1 | SUBSTITUTED IMIDAZOPYRIDAZINES | Bayer Intellectual Property GmbH (DE) | 2013-07-17 | — | — | EP | disclosed |
| WO-2012032031-A1 | SUBSTITUTED IMIDAZOPYRIDAZINES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-03-15 | — | — | WO | disclosed |