Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CLK1 | P49759 | 5/20 | 0.41 |
| ▸ | CLK4 | Q9HAZ1 | 11/20 | 0.39 |
| ▸ | DYRK1A | Q13627 | 4/20 | 0.39 |
| ▸ | CLK2 | P49760 | 3/20 | 0.39 |
| ▸ | DYRK1B | Q9Y463 | 3/20 | 0.39 |
| ▸ | NUDT1 | P36639 | 1/20 | 0.37 |
| ▸ | CYP1A2 | P05177 | 8/20 | 0.37 |
| ▸ | CYP3A4 | P08684 | 8/20 | 0.37 |
| ▸ | LMNA | P02545 | 7/20 | 0.37 |
| ▸ | CYP2D6 | P10635 | 7/20 | 0.37 |
| ▸ | CYP2C19 | P33261 | 7/20 | 0.37 |
| ▸ | ALDH1A1 | P00352 | 6/20 | 0.37 |
| ▸ | MAPK1 | P28482 | 5/20 | 0.37 |
| ▸ | TSHR | P16473 | 5/20 | 0.37 |
| ▸ | USP2 | O75604 | 4/20 | 0.37 |
| ▸ | HSD17B10 | Q99714 | 4/20 | 0.37 |
| ▸ | HIF1A | Q16665 | 3/20 | 0.37 |
| ▸ | KDM4E | B2RXH2 | 3/20 | 0.36 |
| ▸ | MEN1 | O00255 | 2/20 | 0.36 |
| ▸ | KMT2A | Q03164 | 2/20 | 0.36 |
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 | |
|---|---|---|---|---|
| SCHEMBL1675202 | 0.82 | CLK1 (0.44) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675115 | 0.82 | CLK1 (0.61) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675323 | 0.79 | CLK4 (0.53) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675140 | 0.76 | CLK1 (0.70) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675295 | 0.71 | CLK4 (0.55) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675204 | 0.70 | CLK1 (0.71) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL693 | 0.65 | TSHR (0.47) | CYP3A4LMNACYP2C19ALDH1A1TSHR | |
| SCHEMBL1675336 | 0.64 | CLK1 (0.68) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL1675222 | 0.64 | CLK1 (0.67) | CLK1CLK4DYRK1ACLK2DYRK1B | |
| SCHEMBL3504414 | 0.63 | TSHR (0.56) | CYP3A4LMNACYP2C19ALDH1A1MAPK1 |
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 2 patents. claimed = in the patent's claims; disclosed = body only.
| Patent | Title | Assignee | Published | Priority | Filing | Country | Status |
|---|---|---|---|---|---|---|---|
| WO-2011041655-A1 | QUINAZOLIN-4-AMINE DERIVATIVES; AND METHODS OF USE | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-04-07 | — | — | WO | claimed |
| WO-2011041655-A1 | QUINAZOLIN-4-AMINE DERIVATIVES; AND METHODS OF USE | THE UNITED STATES OF AMERICA, AS REPRESENTED BY THE SECRETARY, DEPARTMENT OF HEALTH AND HUMAN SERVICES (US) | 2011-04-07 | — | — | WO | disclosed |