Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 8/20 | 0.49 |
| ▸ | CLK4 | Q9HAZ1 | 8/20 | 0.49 |
| ▸ | PIK3CA | P42336 | 2/20 | 0.47 |
| ▸ | PIK3CB | P42338 | 1/20 | 0.47 |
| ▸ | PIK3CG | P48736 | 1/20 | 0.47 |
| ▸ | CLK1 | P49759 | 6/20 | 0.44 |
| ▸ | CLK2 | P49760 | 6/20 | 0.44 |
| ▸ | DYRK1B | Q9Y463 | 6/20 | 0.44 |
| ▸ | CLK3 | P49761 | 3/20 | 0.44 |
| ▸ | CDK2 | P24941 | 1/20 | 0.44 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.43 |
| ▸ | L3MBTL1 | Q9Y468 | 1/20 | 0.43 |
| ▸ | ADORA1 | P30542 | 3/20 | 0.43 |
| ▸ | ADORA2A | P29274 | 2/20 | 0.43 |
| ▸ | ADORA3 | P0DMS8 | 1/20 | 0.43 |
| ▸ | RET | P07949 | 1/20 | 0.43 |
| ▸ | NPC1 | O15118 | 3/20 | 0.42 |
| ▸ | RAB9A | P51151 | 3/20 | 0.42 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.42 |
| ▸ | POLB | P06746 | 2/20 | 0.42 |
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 | |
|---|---|---|---|---|
| SCHEMBL3720119 | 0.81 | ACP1 (0.44) | PIK3CAPIK3CBPIK3CGALDH1A1KDM4E | |
| SCHEMBL3721197 | 0.80 | ADORA1 (0.51) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3720589 | 0.80 | CLK4 (0.48) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3722007 | 0.77 | CLK4 (0.71) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3723229 | 0.77 | ADORA1 (0.48) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3721028 | 0.73 | ADORA1 (0.48) | ALDH1A1L3MBTL1ADORA1ADORA2AADORA3 | |
| SCHEMBL3718806 | 0.72 | KDM4E (0.49) | DYRK1ACLK4ALDH1A1ADORA1ADORA2A | |
| SCHEMBL3717907 | 0.72 | CLK4 (0.52) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3725579 | 0.72 | DYRK1A (0.65) | DYRK1ACLK4CLK1CLK2DYRK1B | |
| SCHEMBL3724659 | 0.71 | DYRK1A (0.51) | DYRK1ACLK4CLK1CLK2DYRK1B |
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 |