Predicted protein targets (top 14)
| gene | UniProt | supporting neighbours | confidence | |
|---|---|---|---|---|
| ▸ | KDR | P35968 | 12/20 | 0.53 |
| ▸ | EGFR | P00533 | 2/20 | 0.45 |
| ▸ | RAF1 | P04049 | 1/20 | 0.45 |
| ▸ | BRAF | P15056 | 1/20 | 0.45 |
| ▸ | TNNI3K | Q59H18 | 1/20 | 0.44 |
| ▸ | ERBB2 | P04626 | 1/20 | 0.43 |
| ▸ | BRD4 | O60885 | 1/20 | 0.42 |
| ▸ | MAPK14 | Q16539 | 2/20 | 0.42 |
| ▸ | CA12 | O43570 | 1/20 | 0.41 |
| ▸ | CA1 | P00915 | 1/20 | 0.41 |
| ▸ | CA2 | P00918 | 1/20 | 0.41 |
| ▸ | CA9 | Q16790 | 1/20 | 0.41 |
| ▸ | CCNT1 | O60563 | 1/20 | 0.41 |
| ▸ | CDK9 | P50750 | 1/20 | 0.41 |
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 | |
|---|---|---|---|---|
| SCHEMBL5740324 | 0.92 | KDR (0.54) | KDREGFRERBB2MAPK14 | |
| SCHEMBL5740244 | 0.86 | KDR (0.54) | KDREGFRRAF1BRAFERBB2 | |
| SCHEMBL5730197 | 0.86 | KDR (0.56) | KDREGFRMAPK14 | |
| SCHEMBL5739893 | 0.85 | KDR (0.71) | KDREGFRERBB2MAPK14 | |
| SCHEMBL4112705 | 0.85 | KDR (0.74) | KDREGFRERBB2MAPK14 | |
| SCHEMBL5748880 | 0.85 | KDR (0.47) | KDREGFRTNNI3KERBB2MAPK14 | |
| SCHEMBL5739937 | 0.84 | KDR (0.56) | KDREGFRERBB2MAPK14 | |
| SCHEMBL5739127 | 0.83 | KDR (0.56) | KDRMAPK14 | |
| SCHEMBL5739216 | 0.83 | KDR (0.55) | KDREGFRERBB2MAPK14 | |
| SCHEMBL5739549 | 0.82 | KDR (0.54) | KDREGFRERBB2MAPK14 |
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 |