Predicted protein targets (top 17)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 14/20 | 0.59 |
| ▸ | EGFR | P00533 | 10/20 | 0.58 |
| ▸ | AURKA | O14965 | 1/20 | 0.58 |
| ▸ | HDAC3 | O15379 | 5/20 | 0.50 |
| ▸ | HDAC4 | P56524 | 5/20 | 0.50 |
| ▸ | HDAC1 | Q13547 | 5/20 | 0.50 |
| ▸ | HDAC7 | Q8WUI4 | 5/20 | 0.50 |
| ▸ | HDAC2 | Q92769 | 5/20 | 0.50 |
| ▸ | HDAC10 | Q969S8 | 5/20 | 0.50 |
| ▸ | HDAC11 | Q96DB2 | 5/20 | 0.50 |
| ▸ | HDAC8 | Q9BY41 | 5/20 | 0.50 |
| ▸ | HDAC6 | Q9UBN7 | 5/20 | 0.50 |
| ▸ | HDAC9 | Q9UKV0 | 5/20 | 0.50 |
| ▸ | HDAC5 | Q9UQL6 | 5/20 | 0.50 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.49 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.49 |
| ▸ | IRAK4 | Q9NWZ3 | 1/20 | 0.49 |
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 | |
|---|---|---|---|---|
| SCHEMBL5086276 | 0.98 | AURKA (0.59) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5090002 | 0.90 | KDR (0.63) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5022333 | 0.89 | KDR (0.59) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5085254 | 0.89 | KDR (0.61) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5089035 | 0.88 | KDR (0.60) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5022364 | 0.87 | AURKA (0.60) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5094864 | 0.87 | KDR (0.59) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5026727 | 0.87 | KDR (0.57) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5087029 | 0.86 | KDR (0.59) | KDREGFRAURKAHDAC3HDAC4 | |
| SCHEMBL5025447 | 0.86 | KDR (0.71) | KDREGFRAURKAHDAC3HDAC4 |
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-1575966-B1 | THERAPEUTIC QUINAZOLINE DERIVATIVES | ASTRAZENECA AB (SE) | 2008-10-29 | — | — | EP | claimed |