Predicted protein targets (top 4)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 9/20 | 0.44 |
| ▸ | MAPK14 | Q16539 | 10/20 | 0.40 |
| ▸ | AURKA | O14965 | 1/20 | 0.39 |
| ▸ | AURKB | Q96GD4 | 1/20 | 0.39 |
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 | |
|---|---|---|---|---|
| SCHEMBL5740276 | 0.84 | KDR (0.43) | KDRMAPK14 | |
| SCHEMBL4050114 | 0.83 | KDR (0.60) | KDRMAPK14 | |
| SCHEMBL14469942 | 0.80 | KDR (0.43) | KDRMAPK14 | |
| SCHEMBL5741996 | 0.80 | KDR (0.42) | KDRMAPK14 | |
| SCHEMBL6112565 | 0.78 | MAP2K1 (0.59) | KDRMAPK14 | |
| SCHEMBL5740103 | 0.78 | KDR (0.59) | KDRMAPK14 | |
| SCHEMBL5740776 | 0.77 | KDR (0.53) | KDRMAPK14 | |
| SCHEMBL5739989 | 0.77 | KDR (0.53) | KDRMAPK14 | |
| SCHEMBL5740473 | 0.77 | MAP2K1 (0.52) | KDRMAPK14 | |
| SCHEMBL5739719 | 0.76 | KDR (0.57) | KDRMAPK14 |
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-1183033-B1 | PYRROLOTRIAZINE INHIBITORS OF KINASES | BRISTOL MYERS SQUIBB CO (US) | 2006-03-01 | — | — | EP | claimed |