Predicted protein targets (top 9)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 15/20 | 0.55 |
| ▸ | CYP3A4 | P08684 | 1/20 | 0.36 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.36 |
| ▸ | CYP2C19 | P33261 | 1/20 | 0.36 |
| ▸ | KDM4E | B2RXH2 | 1/20 | 0.36 |
| ▸ | FYN | P06241 | 1/20 | 0.35 |
| ▸ | SYK | P43405 | 1/20 | 0.34 |
| ▸ | PIM1 | P11309 | 1/20 | 0.34 |
| ▸ | ERN1 | O75460 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL470040 | 0.88 | TTK (0.69) | TTKCYP3A4CYP2C9CYP2C19FYN | |
| SCHEMBL457024 | 0.80 | TTK (0.83) | TTKCYP3A4CYP2C9CYP2C19 | |
| SCHEMBL470023 | 0.80 | TTK (0.68) | TTKCYP3A4CYP2C9CYP2C19FYN | |
| SCHEMBL462359 | 0.78 | TTK (0.42) | TTKSYK | |
| SCHEMBL470033 | 0.77 | TTK (0.56) | TTKCYP3A4FYNPIM1 | |
| SCHEMBL470148 | 0.76 | TTK (0.55) | TTKERN1 | |
| SCHEMBL470039 | 0.76 | TTK (0.61) | TTK | |
| SCHEMBL12466791 | 0.75 | ERN1 (0.43) | TTKFYNSYKERN1 | |
| SCHEMBL469947 | 0.74 | TTK (0.55) | TTK | |
| SCHEMBL462101 | 0.74 | TTK (0.42) | 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 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 | claimed |
| WO-2012032031-A1 | SUBSTITUTED IMIDAZOPYRIDAZINES | BAYER PHARMA AKTIENGESELLSCHAFT (DE) | 2012-03-15 | — | — | WO | claimed |