Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | NEK2 | P51955 | 3/20 | 0.69 |
| ▸ | MAP2K1 | Q02750 | 1/20 | 0.46 |
| ▸ | KIF20A | O95235 | 1/20 | 0.43 |
| ▸ | CLK1 | P49759 | 1/20 | 0.43 |
| ▸ | CLK2 | P49760 | 1/20 | 0.43 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.43 |
| ▸ | DYRK1A | Q13627 | 1/20 | 0.43 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.43 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.43 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.43 |
| ▸ | CAMKK2 | Q96RR4 | 2/20 | 0.41 |
| ▸ | BRD4 | O60885 | 1/20 | 0.39 |
| ▸ | PLK1 | P53350 | 1/20 | 0.39 |
| ▸ | AAK1 | Q2M2I8 | 1/20 | 0.38 |
| ▸ | KDR | P35968 | 1/20 | 0.38 |
| ▸ | CNR2 | P34972 | 1/20 | 0.38 |
| ▸ | PRKCI | P41743 | 1/20 | 0.37 |
| ▸ | BRAF | P15056 | 1/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 1/20 | 0.37 |
| ▸ | CYP2C9 | P11712 | 1/20 | 0.37 |
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 | |
|---|---|---|---|---|
| SCHEMBL12675734 | 0.90 | NEK2 (0.76) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL12675996 | 0.88 | NEK2 (0.67) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL16450324 | 0.86 | NEK2 (0.73) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL1907443 | 0.85 | NEK2 (0.80) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL1907441 | 0.85 | NEK2 (0.80) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL1907324 | 0.82 | NEK2 (0.67) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL1907853 | 0.82 | NEK2 (1.00) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL1907851 | 0.82 | NEK2 (1.00) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL12676007 | 0.81 | NEK2 (0.66) | NEK2MAP2K1KIF20ACLK1CLK2 | |
| SCHEMBL3709076 | 0.80 | NEK2 (0.63) | NEK2MAP2K1CLK2CDK5DYRK1A |
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-2011060440-A2 | KINASE INHIBITORS | THE REGENTS OF THE UNIVERSITY OF CALIFORNIA (US) | 2011-05-19 | — | — | WO | disclosed |