Predicted protein targets (top 7)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.50 |
| ▸ | CYP3A4 | P08684 | 2/20 | 0.43 |
| ▸ | KCNH2 | Q12809 | 1/20 | 0.38 |
| ▸ | TNNI3K | Q59H18 | 5/20 | 0.36 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.35 |
| ▸ | MKNK1 | Q9BUB5 | 1/20 | 0.34 |
| ▸ | MKNK2 | Q9HBH9 | 1/20 | 0.34 |
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 | |
|---|---|---|---|---|
| SCHEMBL1683441 | 0.85 | KDR (0.67) | KDRCYP3A4KCNH2 | |
| SCHEMBL1683445 | 0.82 | KDR (0.60) | KDRCYP3A4KCNH2MKNK1MKNK2 | |
| SCHEMBL1683447 | 0.82 | KDR (0.60) | KDRCYP3A4KCNH2MKNK1MKNK2 | |
| SCHEMBL1683420 | 0.81 | KDR (0.72) | KDRCYP3A4KCNH2 | |
| SCHEMBL1683425 | 0.81 | KDR (0.72) | KDRCYP3A4KCNH2 | |
| SCHEMBL1683393 | 0.78 | KDR (0.68) | KDRCYP3A4KCNH2 | |
| SCHEMBL1683443 | 0.73 | KDR (0.61) | KDRCYP3A4 | |
| SCHEMBL1683383 | 0.71 | KDR (0.74) | KDRCYP3A4KCNH2 | |
| SCHEMBL1683473 | 0.71 | KDR (0.67) | KDRMAPK14 | |
| SCHEMBL1227338 | 0.70 | KDR (0.82) | KDRCYP3A4KCNH2 |
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-1539763-B1 | AZAINDOLE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2011-04-13 | — | — | EP | claimed |
| EP-1539763-B1 | AZAINDOLE KINASE INHIBITORS | BRISTOL MYERS SQUIBB CO (US) | 2011-04-13 | — | — | EP | disclosed |