Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK4 | Q9HAZ1 | 12/20 | 0.71 |
| ▸ | DYRK1A | Q13627 | 9/20 | 0.71 |
| ▸ | CLK1 | P49759 | 8/20 | 0.71 |
| ▸ | CLK2 | P49760 | 5/20 | 0.71 |
| ▸ | DYRK1B | Q9Y463 | 5/20 | 0.71 |
| ▸ | CLK3 | P49761 | 3/20 | 0.71 |
| ▸ | CDK2 | P24941 | 1/20 | 0.71 |
| ▸ | ALDH1A1 | P00352 | 7/20 | 0.61 |
| ▸ | KDM4E | B2RXH2 | 6/20 | 0.61 |
| ▸ | HSD17B10 | Q99714 | 5/20 | 0.61 |
| ▸ | CYP1A2 | P05177 | 4/20 | 0.61 |
| ▸ | CYP3A4 | P08684 | 4/20 | 0.61 |
| ▸ | CYP2D6 | P10635 | 4/20 | 0.61 |
| ▸ | CYP2C19 | P33261 | 4/20 | 0.61 |
| ▸ | CYP2C9 | P11712 | 3/20 | 0.61 |
| ▸ | SMN1; SMN2 | Q16637 | 3/20 | 0.61 |
| ▸ | ALOX15 | P16050 | 2/20 | 0.61 |
| ▸ | MAPK1 | P28482 | 2/20 | 0.61 |
| ▸ | HPGD | P15428 | 2/20 | 0.61 |
| ▸ | TP53 | P04637 | 2/20 | 0.61 |
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 | |
|---|---|---|---|---|
| SCHEMBL3723029 | 0.81 | KDM4E (0.53) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3718626 | 0.78 | KDM4E (0.61) | CDK2ALDH1A1KDM4EHSD17B10CYP1A2 | |
| SCHEMBL3723229 | 0.78 | ADORA1 (0.48) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3719658 | 0.77 | DYRK1A (0.49) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3721197 | 0.77 | ADORA1 (0.51) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL1076858 | 0.75 | CLK4 (0.67) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3725579 | 0.74 | DYRK1A (0.65) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3717907 | 0.74 | CLK4 (0.52) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL3724659 | 0.74 | DYRK1A (0.51) | CLK4DYRK1ACLK1CLK2DYRK1B | |
| SCHEMBL30250542 | 0.74 | CLK4 (1.00) | CLK4DYRK1ACLK1CLK2DYRK1B |
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-2010141805-A1 | HETEROCYCLIC AMIDES AS MODULATORS OF TRPA1 | JANSSEN PHARMACEUTICA NV (BE) | 2010-12-09 | — | — | WO | disclosed |