Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TTK | P33981 | 20/20 | 0.68 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.68 |
| ▸ | PLK4 | O00444 | 3/20 | 0.68 |
| ▸ | CHEK2 | O96017 | 3/20 | 0.68 |
| ▸ | CYP3A4 | P08684 | 3/20 | 0.68 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.68 |
| ▸ | AURKA | O14965 | 2/20 | 0.68 |
| ▸ | CYP1A1 | P04798 | 2/20 | 0.68 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.68 |
| ▸ | CYP2E1 | P05181 | 2/20 | 0.68 |
| ▸ | CYP2C8 | P10632 | 2/20 | 0.68 |
| ▸ | CYP2D6 | P10635 | 2/20 | 0.68 |
| ▸ | CYP2A6 | P11509 | 2/20 | 0.68 |
| ▸ | CYP4B1 | P13584 | 2/20 | 0.68 |
| ▸ | CYP2B6 | P20813 | 2/20 | 0.68 |
| ▸ | CYP3A5 | P20815 | 2/20 | 0.68 |
| ▸ | CYP2A7 | P20853 | 2/20 | 0.68 |
| ▸ | CYP3A7 | P24462 | 2/20 | 0.68 |
| ▸ | CYP2F1 | P24903 | 2/20 | 0.68 |
| ▸ | CYP2C18 | P33260 | 2/20 | 0.68 |
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 | |
|---|---|---|---|---|
| SCHEMBL12281934 | 0.86 | TTK (0.70) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12281691 | 0.85 | TTK (0.69) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL2584612 | 0.84 | TTK (0.79) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12280882 | 0.84 | TTK (0.79) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL2580241 | 0.82 | TTK (0.72) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12281481 | 0.81 | TTK (0.70) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12282758 | 0.80 | TTK (0.69) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12282801 | 0.80 | TTK (0.69) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12284550 | 0.80 | TTK (0.69) | TTKAURKBPLK4CHEK2CYP3A4 | |
| SCHEMBL12281536 | 0.79 | TTK (0.70) | TTKAURKBPLK4CHEK2CYP3A4 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |
| WO-2011123937-A1 | KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIVERSITY HEALTH NETWORK (CA) | 2011-10-13 | — | — | WO | disclosed |