Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | GSK3B | P49841 | 11/20 | 0.76 |
| ▸ | FLT3 | P36888 | 10/20 | 0.71 |
| ▸ | KDR | P35968 | 15/20 | 0.68 |
| ▸ | FLT4 | P35916 | 5/20 | 0.50 |
| ▸ | TEK | Q02763 | 5/20 | 0.50 |
| ▸ | PLK4 | O00444 | 4/20 | 0.50 |
| ▸ | AURKA | O14965 | 4/20 | 0.50 |
| ▸ | PTK2 | Q05397 | 4/20 | 0.50 |
| ▸ | SRC | P12931 | 3/20 | 0.50 |
| ▸ | PDGFRB | P09619 | 2/20 | 0.50 |
| ▸ | NUAK1 | O60285 | 1/20 | 0.50 |
| ▸ | QPCT | Q16769 | 1/20 | 0.49 |
| ▸ | EGFR | P00533 | 1/20 | 0.48 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.48 |
| ▸ | INSR | P06213 | 1/20 | 0.48 |
| ▸ | IGF1R | P08069 | 1/20 | 0.48 |
| ▸ | MET | P08581 | 1/20 | 0.48 |
| ▸ | CDK4 | P11802 | 1/20 | 0.48 |
| ▸ | BRAF | P15056 | 1/20 | 0.48 |
| ▸ | CCND1 | P24385 | 1/20 | 0.48 |
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 | |
|---|---|---|---|---|
| SCHEMBL10069744 | 0.86 | GSK3B (1.00) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL18655336 | 0.85 | GSK3B (0.86) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL9954914 | 0.84 | GSK3B (0.87) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL9955798 | 0.83 | GSK3B (1.00) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL18655374 | 0.82 | GSK3B (0.87) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL9956127 | 0.81 | KDR (1.00) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL12507153 | 0.81 | KDR (1.00) | GSK3BFLT3KDR | |
| SCHEMBL9955401 | 0.81 | GSK3B (1.00) | GSK3BFLT3KDRQPCTCDK4 | |
| SCHEMBL18655375 | 0.81 | GSK3B (0.79) | GSK3BFLT3KDRFLT4TEK | |
| SCHEMBL12607357 | 0.80 | GSK3B (1.00) | GSK3BFLT3KDR |
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-2655359-B1 | CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT | Johannes-Gutenberg-Universität Mainz (DE) | 2017-03-22 | — | — | EP | disclosed |