Predicted protein targets (top 20)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 10/20 | 0.61 |
| ▸ | EPHB4 | P54760 | 7/20 | 0.61 |
| ▸ | EPHA2 | P29317 | 6/20 | 0.61 |
| ▸ | EGFR | P00533 | 11/20 | 0.58 |
| ▸ | ERBB2 | P04626 | 7/20 | 0.57 |
| ▸ | FBP1 | P09467 | 2/20 | 0.57 |
| ▸ | AURKA | O14965 | 1/20 | 0.57 |
| ▸ | INSR | P06213 | 1/20 | 0.57 |
| ▸ | PDGFRB | P09619 | 1/20 | 0.57 |
| ▸ | FLT4 | P35916 | 1/20 | 0.57 |
| ▸ | CLK1 | P49759 | 1/20 | 0.57 |
| ▸ | TEK | Q02763 | 1/20 | 0.57 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.57 |
| ▸ | HDAC3 | O15379 | 2/20 | 0.56 |
| ▸ | HDAC4 | P56524 | 2/20 | 0.56 |
| ▸ | HDAC1 | Q13547 | 2/20 | 0.56 |
| ▸ | HDAC7 | Q8WUI4 | 2/20 | 0.56 |
| ▸ | HDAC2 | Q92769 | 2/20 | 0.56 |
| ▸ | HDAC10 | Q969S8 | 2/20 | 0.56 |
| ▸ | HDAC11 | Q96DB2 | 2/20 | 0.56 |
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 | |
|---|---|---|---|---|
| SCHEMBL6265759 | 1.00 | KDR (0.61) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL6506916 | 0.86 | EPHA2 (0.61) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL6506913 | 0.86 | EPHA2 (0.61) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL7812296 | 0.83 | EPHB4 (0.68) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL7814454 | 0.83 | EPHB4 (0.68) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL641952 | 0.82 | EGFR (0.73) | KDREPHB4EGFRERBB2FBP1 | |
| SCHEMBL4231129 | 0.81 | EGFR (0.74) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL4234803 | 0.81 | EGFR (0.74) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL9259 | 0.80 | KDR (0.77) | KDREPHB4EPHA2EGFRERBB2 | |
| SCHEMBL643027 | 0.80 | EGFR (0.79) | KDREPHB4EGFRERBB2FBP1 |
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-2005097137-A2 | ADVANCED QUINAZOLINE BASED PROTEIN KINASE INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2005-10-20 | — | — | WO | disclosed |
| WO-2005097134-A2 | QUINAZOLINE BASED PROTEIN KINASE INHIBITORS | THE SCRIPPS RESEARCH INSTITUTE (US) | 2005-10-20 | — | — | WO | disclosed |