Predicted protein targets (top 19)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | CDK5 | Q00535 | 2/20 | 0.41 |
| ▸ | CDK5R1 | Q15078 | 2/20 | 0.41 |
| ▸ | CLK1 | P49759 | 1/20 | 0.41 |
| ▸ | DYRK1A | Q13627 | 2/20 | 0.40 |
| ▸ | ALDH1A1 | P00352 | 1/20 | 0.39 |
| ▸ | PKM | P14618 | 1/20 | 0.39 |
| ▸ | MET | P08581 | 7/20 | 0.39 |
| ▸ | KDR | P35968 | 4/20 | 0.39 |
| ▸ | GSK3B | P49841 | 1/20 | 0.37 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.35 |
| ▸ | CCNA2 | P20248 | 1/20 | 0.35 |
| ▸ | CDK2 | P24941 | 1/20 | 0.35 |
| ▸ | CDK9 | P50750 | 1/20 | 0.35 |
| ▸ | KIF11 | P52732 | 1/20 | 0.35 |
| ▸ | AXL | P30530 | 2/20 | 0.34 |
| ▸ | COMT | P21964 | 1/20 | 0.34 |
| ▸ | TNKS | O95271 | 1/20 | 0.34 |
| ▸ | MAPKAPK2 | P49137 | 1/20 | 0.34 |
| ▸ | NOTUM | Q6P988 | 1/20 | 0.33 |
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 | |
|---|---|---|---|---|
| SCHEMBL29827188 | 0.85 | MET (0.49) | METKDRAXL | |
| SCHEMBL15084519 | 0.85 | MET (0.49) | METKDRAXL | |
| SCHEMBL1743421 | 0.85 | LRRK2 (0.41) | CDK5DYRK1AMETKDRGSK3B | |
| SCHEMBL15084629 | 0.83 | CDK2 (0.43) | CDK5CLK1DYRK1AMETKDR | |
| SCHEMBL15084547 | 0.82 | PARP1 (0.42) | ALDH1A1METKDRCDK2AXL | |
| SCHEMBL1741221 | 0.81 | MET (0.51) | METKDRAXL | |
| SCHEMBL15084554 | 0.80 | EGFR (0.44) | DYRK1AMETKDRGSK3BAXL | |
| SCHEMBL1741232 | 0.78 | MET (0.47) | METKDRAXL | |
| SCHEMBL15084548 | 0.76 | CDK2 (0.46) | ALDH1A1METKDRGSK3BCCNT1 | |
| SCHEMBL15084550 | 0.74 | CCNE2 (0.44) | ALDH1A1PKMMETKDRCDK2 |
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-2013097753-A1 | FUSED HETEROCYCLIC DERIVATIVE AND APPLICATION THEREOF | 江苏先声药业有限公司 (CN) | 2013-07-04 | — | — | WO | disclosed |