Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NTRK1 | P04629 | 5/20 | 0.51 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.46 |
| ▸ | GSK3B | P49841 | 7/20 | 0.40 |
| ▸ | ALK | Q9UM73 | 5/20 | 0.40 |
| ▸ | INSR | P06213 | 4/20 | 0.40 |
| ▸ | CYP1A2 | P05177 | 2/20 | 0.40 |
| ▸ | IGF1R | P08069 | 2/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.40 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.40 |
| ▸ | PLK4 | O00444 | 1/20 | 0.36 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.36 |
| ▸ | PRKCG | P05129 | 1/20 | 0.36 |
| ▸ | ROS1 | P08922 | 1/20 | 0.36 |
| ▸ | FER | P16591 | 1/20 | 0.36 |
| ▸ | LTK | P29376 | 1/20 | 0.36 |
| ▸ | WEE1 | P30291 | 1/20 | 0.36 |
| ▸ | FRK | P42685 | 1/20 | 0.36 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.36 |
| ▸ | MST1R | Q04912 | 1/20 | 0.36 |
| ▸ | PTK2 | Q05397 | 1/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL17848153 | 0.91 | DYRK1A (0.47) | NTRK1DYRK1AGSK3BALKINSR | |
| SCHEMBL3510459 | 0.81 | NTRK1 (0.77) | NTRK1ALKINSRIGF1RAURKA | |
| SCHEMBL17848138 | 0.75 | JAK2 (0.41) | NTRK1DYRK1AGSK3BAURKBPLK4 | |
| SCHEMBL17848139 | 0.74 | GSK3B (0.47) | NTRK1DYRK1AGSK3BALKCYP1A2 | |
| SCHEMBL17848094 | 0.73 | NTRK1 (0.39) | NTRK1DYRK1AGSK3BALKINSR | |
| SCHEMBL17859174 | 0.72 | CYP2C9 (0.33) | NTRK1ALKINSRPARP1 | |
| SCHEMBL17848098 | 0.71 | DYRK1A (0.85) | DYRK1AGSK3B | |
| SCHEMBL6855281 | 0.71 | DYRK1A (0.67) | NTRK1DYRK1AGSK3BAURKBPLK4 | |
| SCHEMBL3510565 | 0.70 | NTRK1 (0.49) | NTRK1DYRK1AGSK3BALKINSR | |
| SCHEMBL591466 | 0.69 | NTRK1 (0.47) | NTRK1DYRK1AGSK3BALKINSR |
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-3233840-A1 | HETEROCYCLIC DERIVATIVES MODULATING ACTIVITY OF CERTAIN PROTEIN KINASES | Eudendron S.r.l. (IT) | 2017-10-25 | — | — | EP | disclosed |
| WO-2016096709-A1 | HETEROCYCLIC DERIVATIVES MODULATING ACTIVITY OF CERTAIN PROTEIN KINASES | EUDENDRON S.R.L. (IT) | 2016-06-23 | — | — | WO | disclosed |