Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | DYRK1A | Q13627 | 2/20 | 0.73 |
| ▸ | LIMK1 | P53667 | 3/20 | 0.54 |
| ▸ | KDM4E | B2RXH2 | 2/20 | 0.49 |
| ▸ | ALDH1A1 | P00352 | 2/20 | 0.49 |
| ▸ | SMN1; SMN2 | Q16637 | 1/20 | 0.49 |
| ▸ | ADORA1 | P30542 | 2/20 | 0.49 |
| ▸ | ADORA2A | P29274 | 1/20 | 0.49 |
| ▸ | ACHE | P22303 | 5/20 | 0.47 |
| ▸ | BCHE | P06276 | 1/20 | 0.47 |
| ▸ | CHEK1 | O14757 | 1/20 | 0.44 |
| ▸ | DAPK3 | O43293 | 1/20 | 0.44 |
| ▸ | LTK | P29376 | 1/20 | 0.44 |
| ▸ | MAPK8 | P45983 | 1/20 | 0.44 |
| ▸ | CSNK1A1 | P48729 | 1/20 | 0.44 |
| ▸ | CDK8 | P49336 | 1/20 | 0.44 |
| ▸ | CDK5 | Q00535 | 1/20 | 0.44 |
| ▸ | LRRK2 | Q5S007 | 1/20 | 0.44 |
| ▸ | CLK4 | Q9HAZ1 | 1/20 | 0.44 |
| ▸ | DYRK1B | Q9Y463 | 1/20 | 0.44 |
| ▸ | KDR | P35968 | 3/20 | 0.43 |
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 | |
|---|---|---|---|---|
| SCHEMBL10339508 | 0.84 | DYRK1A (1.00) | DYRK1ALIMK1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL17636721 | 0.79 | ADORA2A (0.61) | DYRK1ALIMK1KDM4ESMN1; SMN2ADORA1 | |
| SCHEMBL13790500 | 0.79 | DYRK1A (0.50) | DYRK1ALIMK1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL21292583 | 0.71 | ACHE (0.64) | DYRK1ALIMK1ADORA1ADORA2AACHE | |
| SCHEMBL30996388 | 0.70 | DYRK1A (0.66) | DYRK1ALIMK1KDM4EALDH1A1SMN1; SMN2 | |
| SCHEMBL16919900 | 0.69 | ADORA2A (0.50) | DYRK1AKDM4ESMN1; SMN2ADORA1ADORA2A | |
| SCHEMBL2962308 | 0.68 | ADORA1 (0.41) | DYRK1ALIMK1KDM4ESMN1; SMN2ADORA1 | |
| SCHEMBL8542955 | 0.68 | ADORA1 (0.41) | DYRK1ALIMK1KDM4ESMN1; SMN2ADORA1 | |
| SCHEMBL16919905 | 0.67 | ADORA2A (0.48) | DYRK1AKDM4EALDH1A1SMN1; SMN2ADORA1 | |
| SCHEMBL11829286 | 0.67 | GABRG2 (0.55) | DYRK1AKDM4EALDH1A1SMN1; SMN2DAPK3 |
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 |
|---|---|---|---|---|---|---|---|
| EP-1673354-B1 | ARYLINDENOPYRIDINES AND ARYLINDENOPYRIMIDINES AND THEIR USE AS ADENOSINE A2A RECEPTOR ANTAGONISTS | ORTHO MCNEIL PHARM INC (US) | 2009-04-22 | — | — | EP | disclosed |