Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | TGFBR1 | P36897 | 3/20 | 0.50 |
| ▸ | RIPK2 | O43353 | 1/20 | 0.50 |
| ▸ | GSK3B | P49841 | 4/20 | 0.48 |
| ▸ | CDK5 | Q00535 | 4/20 | 0.48 |
| ▸ | CLK4 | Q9HAZ1 | 4/20 | 0.48 |
| ▸ | DYRK3 | O43781 | 3/20 | 0.48 |
| ▸ | CLK2 | P49760 | 3/20 | 0.48 |
| ▸ | DYRK1A | Q13627 | 3/20 | 0.48 |
| ▸ | CLK1 | P49759 | 2/20 | 0.48 |
| ▸ | DYRK1B | Q9Y463 | 2/20 | 0.48 |
| ▸ | CLK3 | P49761 | 1/20 | 0.48 |
| ▸ | CDK5R1 | Q15078 | 1/20 | 0.48 |
| ▸ | DYRK2 | Q92630 | 1/20 | 0.48 |
| ▸ | ROCK2 | O75116 | 3/20 | 0.47 |
| ▸ | PIM1 | P11309 | 3/20 | 0.47 |
| ▸ | AR | P10275 | 1/20 | 0.47 |
| ▸ | DAPK3 | O43293 | 3/20 | 0.47 |
| ▸ | ROCK1 | Q13464 | 3/20 | 0.47 |
| ▸ | CDC7 | O00311 | 2/20 | 0.47 |
| ▸ | PRKD3 | O94806 | 2/20 | 0.47 |
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 | |
|---|---|---|---|---|
| SCHEMBL30627398 | 1.00 | TGFBR1 (0.50) | TGFBR1RIPK2GSK3BCDK5CLK4 | |
| SCHEMBL15637538 | 0.83 | TGFBR1 (0.60) | TGFBR1RIPK2ROCK2ARROCK1 | |
| SCHEMBL17909871 | 0.82 | RIPK2 (0.51) | TGFBR1RIPK2GSK3BCDK5CLK4 | |
| SCHEMBL30759594 | 0.81 | BTK (0.52) | CDK5CLK4DYRK1BPIM1DAPK3 | |
| SCHEMBL8523957 | 0.81 | PI4K2A (0.51) | PIM1ARHIPK2STK17AMAP4K4 | |
| SCHEMBL3380293 | 0.80 | TRPA1 (0.59) | TGFBR1GSK3BCDK5CLK4DYRK3 | |
| SCHEMBL15640023 | 0.78 | TGFBR1 (0.70) | TGFBR1GSK3BCDK5CLK4DYRK3 | |
| SCHEMBL31032063 | 0.78 | PARP1 (0.51) | RIPK2PIM1CDC7HIPK2STK17A | |
| SCHEMBL5014101 | 0.77 | CLK1 (0.64) | TGFBR1GSK3BCDK5CLK4DYRK3 | |
| SCHEMBL31032103 | 0.77 | NPC1 (0.57) | TGFBR1GSK3BDYRK1APIM1AR |
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 |
|---|---|---|---|---|---|---|---|
| EP-1259487-A1 | 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS | Novartis AG (CH) | 2002-11-27 | — | — | EP | disclosed |
| WO-2001055114-A1 | 2-AMINO-NICOTINAMIDE DERIVATIVES AND THEIR USE AS VEGF-RECEPTOR TYROSINE KINASE INHIBITORS | NOVARTIS AG (CH) | 2001-08-02 | — | — | WO | disclosed |