Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 17/20 | 0.48 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.48 |
| ▸ | HPGDS | O60760 | 1/20 | 0.40 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.39 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.39 |
| ▸ | NTRK1 | P04629 | 1/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL470200 | 0.84 | TTK (0.55) | TTKCYP3A4 | |
| SCHEMBL458675 | 0.75 | TTK (0.44) | TTKCYP3A4 | |
| SCHEMBL457866 | 0.74 | TTK (0.54) | TTK | |
| SCHEMBL459013 | 0.73 | TTK (0.48) | TTK | |
| SCHEMBL17416416 | 0.73 | TTK (0.61) | TTKCYP3A4 | |
| SCHEMBL10279545 | 0.73 | TTK (0.61) | TTKCYP3A4 | |
| SCHEMBL463296 | 0.72 | TTK (0.55) | TTKCYP3A4 | |
| SCHEMBL17416371 | 0.72 | TTK (0.60) | TTKCYP3A4 | |
| SCHEMBL458141 | 0.71 | TTK (0.61) | TTKCYP3A4 | |
| SCHEMBL15555488 | 0.71 | TTK (0.63) | TTKCYP3A4 |
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 |