Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.53 |
| ▸ | GSK3B | P49841 | 12/20 | 0.53 |
| ▸ | FLT3 | P36888 | 10/20 | 0.53 |
| ▸ | PLK4 | O00444 | 4/20 | 0.44 |
| ▸ | AURKA | O14965 | 4/20 | 0.44 |
| ▸ | FLT4 | P35916 | 4/20 | 0.44 |
| ▸ | TEK | Q02763 | 4/20 | 0.44 |
| ▸ | PDGFRB | P09619 | 3/20 | 0.44 |
| ▸ | SRC | P12931 | 3/20 | 0.44 |
| ▸ | PTK2 | Q05397 | 3/20 | 0.44 |
| ▸ | EGFR | P00533 | 2/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 2/20 | 0.44 |
| ▸ | INSR | P06213 | 2/20 | 0.44 |
| ▸ | IGF1R | P08069 | 2/20 | 0.44 |
| ▸ | MET | P08581 | 2/20 | 0.44 |
| ▸ | CDK4 | P11802 | 2/20 | 0.44 |
| ▸ | BRAF | P15056 | 2/20 | 0.44 |
| ▸ | CCND1 | P24385 | 2/20 | 0.44 |
| ▸ | CDK2 | P24941 | 2/20 | 0.44 |
| ▸ | EPHB4 | P54760 | 2/20 | 0.44 |
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 | |
|---|---|---|---|---|
| SCHEMBL19056963 | 0.91 | KDR (0.44) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL9960974 | 0.83 | KDR (0.61) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL9960975 | 0.80 | KDR (0.50) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL10070115 | 0.77 | KDR (0.73) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL10070114 | 0.76 | GSK3B (0.73) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL19056960 | 0.75 | KDR (0.49) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL10070566 | 0.75 | GSK3B (0.75) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL9960978 | 0.74 | GSK3B (0.61) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL19056964 | 0.74 | GSK3B (0.49) | KDRGSK3BFLT3PLK4AURKA | |
| SCHEMBL10070111 | 0.73 | GSK3B (0.68) | KDRGSK3BFLT3PLK4AURKA |
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-2655359-A1 | CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT | Johannes-Gutenberg-Universität Mainz (DE) | 2013-10-30 | — | — | EP | disclosed |
| WO-2012084683-A1 | CONJUGATED 3-(INDOLYL)- AND 3-(AZAINDOLYL)-4-ARYLMALEIMIDE COMPOUNDS AND THEIR USE IN TUMOR TREATMENT | Johannes Gutenberg-Universität Mainz (DE) | 2012-06-28 | — | — | WO | disclosed |