Predicted protein targets (top 15)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CYP3A4 | P08684 | 5/20 | 0.47 |
| ▸ | TTK | P33981 | 4/20 | 0.47 |
| ▸ | AURKB | Q96GD4 | 4/20 | 0.47 |
| ▸ | INCENP | Q9NQS7 | 4/20 | 0.47 |
| ▸ | OPRK1 | P41145 | 9/20 | 0.39 |
| ▸ | LMNA | P02545 | 2/20 | 0.39 |
| ▸ | SLC5A7 | Q9GZV3 | 2/20 | 0.38 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.38 |
| ▸ | PKM | P14618 | 1/20 | 0.38 |
| ▸ | SLC6A2 | P23975 | 1/20 | 0.37 |
| ▸ | SLC6A3 | Q01959 | 1/20 | 0.37 |
| ▸ | KCNH2 | Q12809 | 8/20 | 0.37 |
| ▸ | OPRM1 | P35372 | 4/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.35 |
| ▸ | NPC1 | O15118 | 1/20 | 0.35 |
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 | |
|---|---|---|---|---|
| SCHEMBL20217592 | 0.89 | CYP3A4 (0.53) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217458 | 0.88 | CYP3A4 (0.50) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217478 | 0.86 | LMNA (0.42) | CYP3A4TTKAURKBINCENPLMNA | |
| SCHEMBL20217570 | 0.86 | CYP3A4 (0.54) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217541 | 0.83 | CYP3A4 (0.49) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217549 | 0.82 | CYP3A4 (0.49) | CYP3A4TTKAURKBINCENPLMNA | |
| SCHEMBL20217349 | 0.82 | CYP3A4 (0.50) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217358 | 0.81 | ACACB (0.38) | CYP3A4TTKAURKBINCENPLMNA | |
| SCHEMBL20217678 | 0.81 | ALDH1A1 (0.38) | CYP3A4TTKAURKBINCENPOPRK1 | |
| SCHEMBL20217390 | 0.80 | TTK (0.63) | CYP3A4TTKAURKBINCENPOPRK1 |
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 |
|---|---|---|---|---|---|---|---|
| EP-2766352-B1 | INDAZOLE COMPOUNDS AS KINASE INHIBITORS AND METHOD OF TREATING CANCER WITH SAME | UNIV HEALTH NETWORK UHN (CA) | 2018-06-06 | — | — | EP | disclosed |