Predicted protein targets (top 3)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEK2 | P51955 | 4/20 | 0.58 |
| ▸ | FLT3 | P36888 | 1/20 | 0.58 |
| ▸ | PLK1 | P53350 | 16/20 | 0.55 |
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 | |
|---|---|---|---|---|
| SCHEMBL20108106 | 0.89 | NEK2 (0.57) | NEK2FLT3PLK1 | |
| SCHEMBL20108284 | 0.82 | NEK2 (0.87) | NEK2FLT3PLK1 | |
| SCHEMBL2502631 | 0.82 | PLK1 (0.65) | NEK2FLT3PLK1 | |
| SCHEMBL2523731 | 0.81 | PLK1 (0.77) | NEK2FLT3PLK1 | |
| SCHEMBL1374710 | 0.81 | PLK1 (0.82) | PLK1 | |
| SCHEMBL2504909 | 0.78 | PLK1 (0.62) | PLK1 | |
| SCHEMBL2503660 | 0.77 | PLK1 (0.77) | PLK1 | |
| SCHEMBL1373276 | 0.77 | PLK1 (0.77) | NEK2FLT3PLK1 | |
| SCHEMBL2502984 | 0.75 | PLK1 (0.67) | PLK1 | |
| SCHEMBL2495256 | 0.75 | PLK1 (0.84) | PLK1 |
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 |
|---|---|---|---|---|---|---|---|
| WO-2018081719-A1 | SMALL MOLECULE INHIBITORS OF NEK2 AND USES THEREOF | ARIZONA BOARD OF REGENTS ON BEHALF OF THE UNIVERSITY OF ARIZONA (US) | 2018-05-03 | — | — | WO | disclosed |